Results for:
PubChem ID: 8183

Dodec-1-ene

Mass-Spectra

Compound Details

Synonymous names
Dodecylene
4-BROMOCYCLOPROPYLBENZENE
DODECENE
CRSBERNSMYQZNG-UHFFFAOYSA-N
alpha-Dodecylene
alpha-Dodecene
n-dodecene
Tetrapropylene (petroleum)
AC1L1QGA
1-DODECENE
Dodecene-1
AC1Q2VZ5
.alpha.-Dodecylene
Adacene 12
ACMC-1C7KA
Neodene 12
Propene, polymers, tetramer
1-Dodecene, analytical standard
WYE669F3GR
Dodec-1-ene
KSC178G4F
.alpha.-Dodecene
2179AA
UNII-WYE669F3GR
S0342
D0974
CTK0H8342
OR01836
Dodecylene .alpha.-
NSC12016
HSDB 1076
HSDB 2793
1-Dodecene (standard material)
n-Dodec-1-ene
Jsp000958
LP082389
SBB059886
DTXSID5026914
CHEMBL1872885
AK113380
A802575
ZINC1718715
CHEBI:89713
DSSTox_CID_6914
NSC 12016
AN-22699
ANW-16466
KB-12052
AX8058146
LS-63547
BB0294653
NSC-12016
ST2419266
TRA0079135
CC-04450
DSSTox_GSID_26914
ZX-AT017312
MFCD00008961
1-Dodecene, 95%
LMFA11000313
DSSTox_RID_78251
C-28176
DB-041090
TR-002429
ST51046150
RTR-002429
ACM25378227
J-002769
AKOS015904161
FT-0689748
FT-0607712
I14-17882
Tox21_303303
Tox21_201382
112-41-4
10004-001i
NCGC00258933-01
MCULE-4843306057
NCGC00164290-01
NCGC00164290-02
NCGC00257096-01
EINECS 246-922-9
EINECS 271-215-7
EINECS 203-968-4
CAS-112-41-4
25378-22-7
1-Dodecene, technical, >=90% (GC)
1-Dodecene, 96% 100g
MolPort-001-756-625
1-Dodecene, >=99.0% (GC)
Microorganism:

Yes

IUPAC namedodec-1-ene
SMILESCCCCCCCCCCC=C
InchiInChI=1S/C12H24/c1-3-5-7-9-11-12-10-8-6-4-2/h3H,1,4-12H2,2H3
FormulaC12H24
PubChem ID8183
Molweight168.324
LogP5.49
Atoms36
Bonds35
H-bond Acceptor0
H-bond Donor0
Chemical ClassificationAlkenes

mVOC Specific Details

Volatilization
The Henry's Law constant for 1-dodecene is estimated as 4.25 atm-cu m/mole(SRC) using a fragment constant estimation method(1). This Henry's Law constant indicates that 1-dodecene is expected to volatilize rapidly from moist soil and 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 1.324 hours(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 120 hours(SRC). However, the volatilization half-life does not take into account the effects of adsorption. An estimated Koc of 5900 (SRC), from a log Kow of 6.10 (SRC) and a regression-derived equation (3), suggests that volatilization could be attenuated by adsorption to suspended solids and sediments in water (SRC). This is apparent from the results of two EXAMS model runs, one in which the effect of adsorption was considered, yielding an estimated half-life of 39 days in a model pond 2 m deep, and one in which the effect of adsorption was ignored, yielding an estimated half-life of 45 hr in a model pond 2 m deep (4). 1-Dodecene's Henry's Law constant(1) indicates that volatilization from moist soil surfaces will occur(SRC). The potential for volatilization of 1-dodecene from dry soil surfaces is not expected(SRC) based upon an estimated vapor pressure of 0.0159 mm Hg 25 deg C(SRC).
Literature: (1) Meylan WM, Howard PH; Environ Toxicol Chem 10: 1283-93 (1991) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 4-9 (1990) (4) USEPA; EXAMS II Computer Simulation (1987)
Soil Adsorption
Using a structure estimation method based on molecular connectivity indices(1), the Koc for 1-dodecene can be estimated to be 5900(SRC). According to a classification scheme(2), this estimated Koc value suggests that 1-dodecene is expected to be immobile in soil(SRC).
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
0.0159 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.
1 MM HG @ 47.2 DEG CSax, N.I. Dangerous Properties of Industrial Materials. 4th ed. New York: Van Nostrand Reinhold, 1975., p. 709
MS-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaPseudomonas Fluorescens R76narhizosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Veronii R02narhizosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Vranovensis R01narhizosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Fragi 25Pn/aErcolini et al., 2009
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaPseudomonas Fluorescens R76LB mediumGC/MSYes
BacteriaPseudomonas Veronii R02LB mediumGC/MSYes
BacteriaPseudomonas Vranovensis R01LB mediumGC/MSYes
BacteriaPseudomonas Fragi 25Pn/an/a