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918403-20-0 | 3-Octadecen-6-ol, 4,5-dimethyl-, (3E)-
CAS No: 918403-20-0 Catalog No: AG006G14 MDL No:
Product Description
Catalog Number:
AG006G14
Chemical Name:
3-Octadecen-6-ol, 4,5-dimethyl-, (3E)-
CAS Number:
918403-20-0
Molecular Formula:
C20H40O
Molecular Weight:
296.5310
IUPAC Name:
4,5-dimethyloctadec-3-en-6-ol
InChI:
InChI=1S/C20H40O/c1-5-7-8-9-10-11-12-13-14-15-17-20(21)19(4)18(3)16-6-2/h16,19-21H,5-15,17H2,1-4H3
InChI Key:
HMYIBUQDZNTYDG-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCC(C(/C(=C/CC)/C)C)O
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.308g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
296.539g/mol
Monoisotopic Mass:
296.308g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
1
XLogP3:
8.5
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