Results for:
PubChem ID: 7844

But-1-ene

Mass-Spectra

Compound Details

Synonymous names
Ethylethylene
VXNZUUAINFGPBY-UHFFFAOYSA-N
BUTENE
alpha-Butylene
alpha-Butene
Butene, homopolymer, phosphosulfurized
n-Butylene
Poly-alpha-butylene
AC1L1POI
AC1Q2SNX
n-Butene
1-Butylene
Actipol E6
1-BUTENE
Butene-1
Butene, polymer-bound
Butene, homopolymer, phosphosulfurized, steam treated
.alpha.-Butylene
1-Butene-4-ylidyneradical
1-Butene, homopolymer
.alpha.-Butene
1-n-Butene
But-1-ene
but-3-ene
UN1012
B0689
B4410
B4411
CTK2F3507
HSDB 179
1-C4H8
CHEMBL117210
Poly(1-butene)
CCRIS 8970
HSDB 5127
LY001N554L
Butene, 1-
DTXSID1026746
LS-2132
OR012135
OR109292
OR131656
OR248134
OR369112
butan-1,2-diyl
CHEBI:48362
UNII-LY001N554L
AN-17664
AN-22456
TRA0084283
1-Butene, >=99%
MFCD00009383
ZINC96328298
DB-040719
LS-178728
LT01409539
RTR-001369
TR-001369
AKOS009156841
FT-0607556
FT-0694873
I14-17824
1-Butene, >=99.6%
106-98-9
3B1-008896
1735-75-7
9003-28-5
MCULE-8167907130
EINECS 203-449-2
EINECS 246-689-3
25038-50-0
25167-67-3
33004-02-3
54366-07-3
61788-35-0
Butylene [UN1012] [Flammable gas]
172345-47-0
197852-64-5
MolPort-019-903-518
10950-EP2269610A2
10950-EP2277848A1
10950-EP2277867A2
10950-EP2280003A2
10950-EP2289510A1
10950-EP2292589A1
10950-EP2295426A1
10950-EP2295427A1
10950-EP2305685A1
10950-EP2305686A1
10950-EP2308960A1
10950-EP2311825A1
10950-EP2311841A1
10950-EP2316457A1
10950-EP2316458A1
10950-EP2316825A1
10950-EP2316826A1
10950-EP2316827A1
10950-EP2316828A1
15423-EP2301927A1
15423-EP2305683A1
15423-EP2311839A1
15423-EP2314589A1
15423-EP2316837A1
15423-EP2374780A1
15423-EP2374781A1
16143-EP2281563A1
16143-EP2308848A1
16143-EP2316459A1
93444-EP2298747A1
93444-EP2301922A1
93444-EP2305641A1
Butylene [UN1012] [Flammable gas]
1-Butene, >=99.0% (GC)
157439-EP2275417A2
157439-EP2284162A2
157439-EP2284163A2
157439-EP2374780A1
157439-EP2374781A1
186918-EP2270113A1
186918-EP2272935A1
186918-EP2374780A1
186918-EP2374781A1
217186-EP2374780A1
InChI=1/C4H8/c1-3-4-2/h3H,1,4H2,2H
Butene, polymer-bound, 50-100 mesh, extent of labeling: 1.0-2.0 mmol vinyl per g loading
Microorganism:

Yes

IUPAC namebut-1-ene
SMILESCCC=C
InchiInChI=1S/C4H8/c1-3-4-2/h3H,1,4H2,2H3
FormulaC4H8
PubChem ID7844
Molweight56.108
LogP1.94
Atoms12
Bonds11
H-bond Acceptor0
H-bond Donor0
Chemical ClassificationAlkenes

mVOC Specific Details

Volatilization
The Henry's Law constant for 1- butene is 0.245 atm-cu m/mole(1). This Henry's Law constant indicates that 1- butene is expected to volatilize rapidly from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 45 minutes (SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 3 days(SRC). 1-Butene's Henry's Law constant(1) indicates that volatilization from moist soil surfaces may occur(SRC). 1-Butene is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 2250 mm Hg(3).
Literature: (1) Yaws CL; Thermodynamics and Physical Property Data, Houston, TX: Gulf Publ Co pp. 217 (1992) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Daubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals: Data Compilation. Design Inst Phys Prop Data, Amer Inst Chem Eng NY, NY: Hemisphere Pub Corp 5 Vol (1989)
Soil Adsorption
Using a structure estimation method based on molecular connectivity indices(1), the Koc for 1-butene can be estimated to be 44(SRC). According to a classification scheme(2), this estimated Koc value suggests that 1-butene is expected to have very high mobility in soil.
Literature: (1) Meylan WM et al; Environ Sci Technol 26: 1560-67 (1992) (2) Swann RL et al; Res Rev 85: 17-28 (1983)
Vapor Pressure
PressureReference
2.253X10+3 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.

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaPseudomonas Fragi 25Pn/aErcolini et al., 2009
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaPseudomonas Fragi 25Pn/an/a