www.ymparisto.fi
 
 
Data bank of environmental chemicals     |     The Finnish Environment Institute (SYKE)
 


26.4.2024

Data bank of environmental properties of chemicals


Chemical
iso-Butanol
CAS-number :
78-83-1
 
Synonyms :
1-hydroxymethylpropane
2-methyl-1-propanol,2-methylpropyl alcohol
2-methylpropan-1-ol
Isobutyl alcohol
isopropylcarbinol
 
Sumformula of the chemical :
C4H10O
EINECS-number :
2011480
 
Uses :
The major use of isobutanol is in the manufacture of isobutyl
acetate, which is employed in the lacquer industry.

Furthermore, isobutanol is used as a solvent in paint and
varnish removers and in the manufacture of isobutyl esters,
which serve as solvents, plasticizers, flavourings, and
perfumes. 
It is also used as a flavouring agent in butter,
cola, fruit, liquor, rum, and whisky (Hall & Oser 1965).

Isobutanol is one of the three main alcohols in fused oil, and
is present in large amounts in some alcoholic beverages
(Hedlund Kiessling 1969).

Natural isobutanol is produced by the fermentation of
carbohydrates. 
Isobutanol is found in some fruits. 
It also
occurs in beverages. 
Isobutanol has been identified in sundry
other foods including cheddar cheese and hop oil (WHO 1987).
 
State and appearance :
Colourless liquid.
 
Odor :
Sweet, similar to that of amyl alcohol, but weaker.

Odour threshold: approximately 4.6 mg/m3 (1.5 ppm).

Quality: sweet, musty
Hedonic tone: unpleasant to pleasant
Threshold odour concentration
absolute: 0.68 ppm
50 % recognition: 1.80 ppm
100 % recognition: 2.05 ppm
Odour index 100 % recognition: 5 131
(Hellman & Small 1974)
 
Molecular weight :
74.12
 
Density, kg/m3 :
801  801-803
803 
 
Conversion factor, 1 ppm in air=_mg/m3 :
3.083  mg/m3
 
Conversion factor, 1 mg/m3 in air=_ppm :
0.324  ppm
 
Water solubility, mg/l :
85000  8.5 wt% (20°C)
 
Boiling point, °C :
107.9 
108  760 mmHg, MITI 1992
 
Log octanol/water coefficient, log Pow :
0.76  Sangster 1989
 
Chemical oxygen demand, g O2/g :
2.46  5 days, Bridie et al. 1979
 
Biochemical oxygen demand, g O2/g :
0.41  5 days, Bridie et al. 1979
 
Half-life in air, days :
0.42  9.96hr - 99.6hr,
4.15  scientific judgement based upon estimated
  photooxidation half-life in air,
  Howard 1991
 
Half-life in soil, days :
1.79  43hr - 173hr,
7.21  scientific judgement based upon estimated
  unacclimated aqueous aerobic biodegradation
  half-life,
  Howard 1991
 
Half-life in water, days :
1.79  43hr - 173hr, in surface water, scientific judgement
7.21  based upon estimated unacclimated aqueous aerobic
  biodegradation half-life,
3.6  3.6d - 14.4d,
14.4  in ground water, scientific judgement based upon
  estimated unacclimated aqueous aerobic
  biodegradation half-life,
  Howard 1991
 
Total degradation in water :
Biodegradation:
90% by BOD
period: 14d
substance: 100 mg/l
sludge: 30 mg/l
(MITI 1992)
 
Ready biodegradability :
Confirmed to be biodegradable (Anon. 1987).
 
Other information of degradation :
Isobutanol is readily biodegradable. 
It is degraded in
significant amounts within a few hours, and degradation would
be expected to be complete within a few days (WHO 1987).

Nazarenko ( 1969) reports an oxygen requirement of
approximately 1.4 mg to oxidize 1 mg of isobutanol.
 
Metabolism in mammals :
In animals, isobutanol is absorbed through the skin, lungs, and
gastrointestinal tract. 
Isobutanol is metabolized by alcohol
dehydrogenase to isobutyric acid via the aldehyde and may enter
the tricarboxylic acid cycle. 
Small amounts of isobutanol are
excreted unchanged, ot as the glucoronide in the urine. 
In
rabbits, metabolites found in the urine include acetaldehyde,
acetic acid, isobutyraldehyde, and isovaleric acid (Saito 
1975).
 
Other information of bioaccumulation :
Isobutanol does no bioaccumulate (Chiou et al. 1977).
 
LD50 values to mammals in oral exposure, mg/kg :
2460  orl-rat, US DHEW 1078
3500  orl-mus,Kushneva et al. 1983
3100  orl-rat
 
LD50 values to mammals in non-oral exposure , mg/kg :
4240  skn-rbt, US DHEW 1978
 
LC50 values to mammals in inhalation exposure, mg/m3 :
19900  ihl-gpg,Kushneva et al.1983
15500  ihl-mus
26250  ihl-rbt
19200  ihl-rat
 
Effects on physiology of mammals :
The acute toxic effects are alcoholic intoxication and
narcosis. 
Isobutanol is severely irritating to the eyes and
moderately irritating to the skin. 
A group of rats given an 1
mol/l solution of isobutanol as their sole drinking liquid for
4 months did not show any adverse effects in the liver; another
group given a 2 mol/l solution as their sole drinking liquid
for 2 months showed a reduction in fat, glycogen, ant RNA
content, and in the overall size of the cells in the liver.

Continuous inhalation exposure of rats to 3 mg/m3 for 4 months
resulted in depression of leg withdrawal response to electrical
stimulation, minor changes of formed elements of the blood and
serum enzymes. 
The estimated NOEC level was 0.1 mg/m3
(WHO 1987).
 
Carcinogenicity :
In a lifetime carcinogenicity study, groups of rats received
isobutanol subcutaneously (0.05 ml/kg body weight twice a week)
or orally (0.2 mg/kg). 
The animals exhibited toxic liver damage
ranging from steatosis to cirrhosis. 
Numbers of animals showing
malignant tumours totalled 8 in the subcutaneous group, 3 in
the oral group, and 0 in the control group. 
The majority of
treated animals also showed hyperplasia of blood-forming
tissues. 
Because of lack of mutagenicity studies, the Task 
Group could not determine whether isobutanol was a genetically 
active compound. 
The findings in the carcinogenicity study are 
a cause of concern. 
Because of methodological inadequacies 
and the manner of reporting the data, it was not possible to 
determine whether isobutanol should be regarded as an animal 
carcinogen. 
Thus it is not possible to extrapolate from this 
study to possible long-term effects in man (WHO 1987).
 
Mutagenicity :
No adequate data are available to assess mutagenicity of
teratogenicity of isobutanol or effects on reproduction 
(WHO 1987).
 
Effects on amphibia :
Threshold for narcosis: 4000 mg/l,Tadpole (Rana sp.),
(Münch 1972).
 
Effects on plants :
Toxicity studies in plants indicate that germination will not
be affected by exposure to isobutanol at background levels. 
An
EC50 of 760 mg/l was reported by Reynolds (1977) for seed
germination in lettuce (Lactuca sativa). 

Smith & Siegel (1975) found an EC50 of 40800 mg/l for seed 
germination in cucumber (Cucumis sativus).
 
Effects on microorganisms :
Table 1 Toxicity of isobutanol to microorganisms (WHO 1987).
_______________________________________________________________
Species      Conc.mg/l   Parameter       Reference
---------------------------------------------------------------
Protozoa
Chilomonas               NOEC 48hr       Bringmann & Kühn
paramaecium    22        total biomass   1981
(flagellate)
Uronema
parduczi      169        NOEC 20 hr      Bringmann & Kühn
(ciliate)                total biomass   1981
Entosiphon
sulcatum      296        NOEC 72hr       Bringmann & Kühn
(flagellate)             total biomass   1981
Bacteria
Pseudomonas              NOEC 16hr       Bringmann & Kühn
putida        280        total biomass   1981
Bacillus                 EC50            Yasuda-Yasaki et al.
subtilis     1180        spore germination               1978
_______________________________________________________________
Toxicity threshold (cell multiplication inhibition test):
bacteria (Pseudomonas putida): 280 mg/l
(Bringmann & Kühn 1980a)
 
EC50 values to microorganism, mg/l :
1224  Microtox, Nacci et al. 1986
14602  Biodegradation inhibition,
  Vaishnav 1986
 
NOEC values to algae, mg/l :
350  8d,grw,Scenedesmus quadricauda
290  8d,grw,Microcystis aeruginosa
  Bringmann & Kühn 1978a
 
LC50 values to crustaceans, mg/l :
1400  24hr,Artemia salina,Price et al.1974
 
EC50 values to crustaceans, mg/l :
1250  24hr,mbt,Daphnia magna
  Bringmann & Kühn 1982
  --
3800  Artemia salina,excyctment
  Smith & Siegel 1975
 
LC50 values to fishes, mg/l :
1520  48hr,Leuciscus idus melanotus
  Juhnke & Lüdemann 1978
  --
2600  24hr,Carassius auratus,Bridie et al.1979
  --
1000  1000-3000,96hr,Alburnus alburnus
3000  Linden et al.1979
  --
1430  96 hr, Pimephales promelas, Brooke et al. 1984
 
EC50 values to fishes, mg/l :
1430  96 hr, Pimephales promelas, Brooke et al. 1984
 
Other information of water organisms :
Toxicity threshold (cell multiplication inhibition test):
green algae (Scenedesmus quadricauda): 350 mg/l
protozoa (Entosiphon sulcatum): 295 mg/l
(Bringmann & Kühn 1980a)

References
1848Anon. 1987a. The list of the existing chemical substances tested on biodegradability by microorganisms or bioaccumulation in fish body by Chemicals Inspection & Testing Institute. Ministry of International Trade and Industry, MITI. Japan.
182Bridie, A.L. et al. 1979. The acute toxicity of some petrochemicals to goldfish. Water Res. 13: 623.
1680Bridie, A.L., Wolff, C.J.M. & Winter, M. 1979. BOD and COD of some petrochemicals. Water Res. 13: 627 - 630.
188Bringmann, G. & Kühn, R. 1980a. Comparison of the toxicity thresholds of water pollutants to bacteria, algae and protozoa in the cell multiplication inhibition test. Water Res. 14: 231 - 241.
1654Bringmann, G. & Kühn, R. 1978. Limit values for the harmful effect of water pollutants on blue-green algae (Microcystis aeruginosa) and green algae (Scenedesmus quadricauda) in the cell multiplication inhibition test. Vom Wasser 50: 45 - 60.
1635Bringmann, G. & Kühn, R. 1981. Comparison of the effect of harmful substances on flagellates, on ciliates, on holozoic bacteriophagic protozoa and on saprozoic protozoa. GWF-Wasser-Abwasser 122(7): 308 - 312.
1655Bringmann, G. & Kühn, R. 1982. Findings concerning the harmful effect of water pollutants on Daphnia magna in an advanced standardized test procedure. Z. Wasser Abwasser Forch. 15(1): 1 - 6.
3295Brooke, L. T. et al. 1984. Acute toxicities of organic chemicals to fathead minnows (Pimephales promelas); Vol 1. Center for Lake Superior Environmental Studies University of Wisconsin-Superior, Superior, Wisconsin, U.S.A.
1624Chiou, C.T. Freed, V.H., Schmedding, D.W. & Kohnert, R.L. 1977. Partition coefficient and bioaccumulation of selected organic chemicals. Environ. Sci. Technol. 11(5): 475 - 478.
1663Council of Europe. 1981. Flavouring substances and natural sources of flavourings. 3rd ed., Strasbourg.
1610Hall, R.L. & Oser, B.L. 1965. Recent progress in the consideration of flavouring ingredients under the food additives amendement. III. Gras substances. Food Technol., 151.
1662Hedlund, S.G. & Kiessling, K.H. 1969. The physiological mechanism involved in hangover. I. The oxidation of some lower aliphatic fused alcohols and aldehydes in rat liver and their effect on the mitochondrial oxidation of various substrates. Acta pharmacol toxicol. 27: 381 - 396.
1673Hellman, T.M. & Small, F.H. 1974. Characterization of the odour properties of 101 petrochemicals using sensory methods. J. Air Pollut. Control Assoc. 24: 979 - 982.
3120Howard, P.H., Boethling, R.S., Jarvis, W.F., Meylan, W.M. & Michalenko, E.M., Handbook of Environmental Degradation Rates, 1991. Lewis Publicers, Inc., Chelsea, Michigan, U.S.A., pp. 725.
1656Juhnke, I & Lüdemann, D. 1978. Results of testing of 200 chemical compounds for acute toxicity in fish by the orfe test. Z. Wasser-Abwasser-Forsch. 11(5): 161 - 164.
1666Kushneva, V.S., Koloskova, G.A., Koltunova, J.G. & Kirilenko, V.T. 1983. Experimental data to hygienic reglementation of isobutylalcohol in the working zone. Gig. Tr. Prof. Zabol. 1: 46 - 47.
831Linden, E., Bengtsson, B-E., Svanberg, O. & Sundström, G. 1979. The acute toxicity of 78 chemicals and pesticide formulations against two brackish water organisms, the bleak (Alburnus alburnus) and the harpacticoid Nitocra spinipes. Chemosphere 11/12: 843 - 851.
3105MITI 1992. Biodegradation and bioaccumulation data of existing chemicals based on the CSCL Japan. Compild under the Safety Division Basic Industries Bureau Ministry of International Trade & Industry, Japan. Edited by Chemicals Inspection & Testing Institute, Japan.
1604Munch. J.C. 1972. Aliphatic alcohols and alkyl esters: narcotic and lethal potencies to tadpoles and to rabbits. Ind. Med. 41(4): 31 - 33.
2417Nacci, D. et al. 1986. Comparative evaluation of three rapid marine toxicity tests: Sea Urchin Early Growth test, Sea Urchin Sperm Cell Toxicity test and Microtox. Environ. Toxicol. Chem. 5: 521.
1664Nazarenko, I.V. 1969. Maximum allowable concentrations for butyl and isobutyl alcohol in drinking water. Sanit. ochrana vodojemov at zagraznen. strochn. vodami. M, Medgiz 4: 65 - 75.
1667Price, K.S. Waggy, G.T. & Conway, R.A. 1974. Brine shrimp bioassay and seawater BOD of petrochemicals. J. Water Pollut. Control. Fed. 46(1): 63 - 77.
1632Reynolds. T. 1977. Comparative effects of aliphatic compounds on inhibition of lettuce fruit germination. Ann. Bot. 41(173): 637 - 648.
1665Saito, M. 1975. Studies on the metabolism of lower alcohols. Nichidai Igaku Zasshi 34(8-9): 569 - 585.
3104Sangster, J. 1989. Octanol-water partition coefficients of simple organic compounds. J. Phys. Chem. Ref. Data, Vol 18, No. 3: 1111 - 1229.
1633Smith, C.W. & Siegel, S.M. 1975. Differential permeation of Artemia cysts and cucumber seeds by alcohols. J. Histochem. Cytochem 23(1): 80 - 83.
1651US DHEW. 1978. Registry of toxic effects of chemicals. Washington DC, US Department of Health, Education and Welfare.
2416Vaishnav, D. D. 1986. Chemical structure-biodegradation inhibition and fish acute toxicity relationships for narcotic industri chemicals. Toxicity Assessment 1: 227.
2413Walker, J. D. 1987. Effects of chemicals on microorganisms. Journal WPCF 59 (6): 614 - 625.
1641WHO 1987. Butanols. Four isomers: 1-butanol, 2-butanol, tert-butanol, isobutanol. Environmental Health Criteria 65.
1636Yasuda-Yasaki, Y., Namike-Kanie, S. & Hachisaku, Y. 1978. Inhibition of germination of Bacillus subtilis spores by alcohols. Spores 7: 13 - 16.

 
 
© Copyright Environmental Administration