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79647-77-1 | 3-Octadecene
CAS No: 79647-77-1 Catalog No: AG005INX MDL No:
Product Description
Catalog Number:
AG005INX
Chemical Name:
3-Octadecene
CAS Number:
79647-77-1
Molecular Formula:
C18H36
Molecular Weight:
252.4784
IUPAC Name:
octadec-3-ene
InChI:
InChI=1S/C18H36/c1-3-5-7-9-11-13-15-17-18-16-14-12-10-8-6-4-2/h5,7H,3-4,6,8-18H2,1-2H3
InChI Key:
OCKCCFAPMYQFLZ-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCC=CCC
Properties
Complexity:
157
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.282g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.486g/mol
Monoisotopic Mass:
252.282g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
9
Literature
| Title | Journal |
|---|---|
| Study of the branched hydrocarbon fraction of intramuscular lipids from Iberian dry-cured ham. | Meat science 20050101 |
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