Results for:
PubChem ID: 6558

2-methylpropan-1-amine

Mass-Spectra

Compound Details

Synonymous names
Monoisobutylamine
ISOBUTYLAMINE
Valamine
KDSNLYIMUZNERS-UHFFFAOYSA-N
Isobutylamine, analytical standard
iso-Butylamine
2-Methylpropylamine
2-Methylpropanamine
isobutyl-amine
isobutyl amine
I-Butylamine
2-methyl aminopropane
N-iso-butylamine
AC1L1MSP
iso-butyl amine
2-methylpropyl amine
AC1Q53LM
AC1Q1PI7
AC1Q1PI6
AC1Q1PI5
1H60H4LOHZ
Isobutylamine, 99%
(2-methylpropyl)amine
KSC492A7L
UNII-1H60H4LOHZ
2-Methyl-1-Aminopropane
UN1214
ACMC-209pfe
2-methylpropane-1-amine
7114AF
NSC8028
iso-C4H9NH2
1-Amino-2-methylpropane
2-methylpropan-1-amine
I0095
3-Methyl-2-propylamine
2-methyl-1-propylamine
2-Methyl-1-propanamine
HSDB 612
CTK3J2075
RP18327
CCRIS 6250
C02787
DTXSID9025459
LS-1755
UN 1214
BBL027687
NSC 8028
NSC-8028
WLN: Z1Y1&1
OR010838
OR341593
OR341594
ZINC4658586
1-Propanamine,2-methyl-
CHEBI:15997
TRA0097433
SC-23248
AN-23960
ANW-37224
KB-52742
MO 08479
MFCD00008146
TR-032035
RTR-032035
AI3-24039
DB-056335
1-Propanamine, 2-methyl-
AKOS000119607
I05-0351
J-510080
FT-0695051
FT-0607317
78-81-9
F2190-0360
Isobutylamine [UN1214] [Flammable liquid]
MCULE-8319193456
EINECS 201-145-4
Isobutylamine [UN1214] [Flammable liquid]
Isobutylamine, purum, >=98.0% (GC)
HYDROGEN(+1) CATION; 2-METHYLPROPAN-1-AMINE
MolPort-001-791-754
79530-EP2305696A2
79530-EP2305695A2
79530-EP2305697A2
79530-EP2305698A2
137382-EP2377849A2
137382-EP2292606A1
137382-EP2287141A1
137382-EP2277848A1
InChI=1/C4H11N/c1-4(2)3-5/h4H,3,5H2,1-2H
Microorganism:

Yes

IUPAC name2-methylpropan-1-amine
SMILESCC(C)CN
InchiInChI=1S/C4H11N/c1-4(2)3-5/h4H,3,5H2,1-2H3
Formula(CH3)2CHCH2NH2
PubChem ID6558
Molweight73.139
LogP0.62
Atoms16
Bonds15
H-bond Acceptor1
H-bond Donor1
Chemical ClassificationAmines

mVOC Specific Details

Volatilization
A pKa of 10.68(1) indicates isobutylamine will exist almost entirely in the cation form at pH values of 5 to 9 and therefore volatilization from water surfaces is not expected to be an important fate process(2). The potential for volatilization of isobutylamine from dry soil surfaces may exist(SRC) based upon a vapor pressure of 138 mm Hg(3).
Literature: (1) Perrin DD; Dissociation constants of organic bases in aqueous solution. IUPAC Chem Data Ser, Buttersworth, London (1965) (2) Doucette WJ; pp. 141-188 in Handbook of Property Estimation Methods for Chemicals. Boethling RS, Mackay D, eds. Boca Raton, FL: Lewis Publ (2000) (3) Daubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals Data Compilation Washington, DC: Taylor and Francis (1989)
Soil Adsorption
The Koc of isobutylamine is estimated as 60(SRC), using a log Kow of 0.73(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that isobutylamine is expected to have high mobility in soil. The pKa of isobutylamine is 10.68(4) indicating that this compound will exist almost entirely in the cation form in the environment and cations generally adsorb more strongly to soils containing organic carbon and clay than their neutral counterparts(5).
Literature: (1) Hansch C et al; Exploring QSAR. Hydrophobic, Electronic, and Steric Constants. ACS Prof Ref Book. Heller SR, consult. ed., Washington, DC: Amer Chem Soc p. 10 (1995) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 4-9 (1990) (3) Swann RL et al; Res Rev 85: 23 (1983) (4) Perrin DD; Dissociation constants of organic bases in aqueous solution. IUPAC Chem Data Ser, Buttersworth, London (1965) (5) Doucette WJ; pp. 141-188 in Handbook of Property Estimation Methods for Chemicals. Boethling RS, Mackay D, eds. Boca Raton, FL: Lewis Publ (2000)
Vapor Pressure
PressureReference
138 mm Hg at 25 deg CDaubert, T.E., R.P. Danner. Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, D.C.: Taylor and Francis, 1989.
MS-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaProteus MirabilisMa et al. 2012Ma Q, Fonseca A, Liu W, Fields AT, Pimsler ML, Spindola AF, Tarone AM, Crippen TL, Tomberlin JK, Wood TK (2012) Proteus mirabilis interkingdom swarming signals attract blow flies. ISME J 6:1356–1366
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaProteus MirabilisLBno