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88580-09-0 | 2,3-Octadecanediol
CAS No: 88580-09-0 Catalog No: AG004DIG MDL No:
Product Description
Catalog Number:
AG004DIG
Chemical Name:
2,3-Octadecanediol
CAS Number:
88580-09-0
Molecular Formula:
C18H38O2
Molecular Weight:
286.4931
IUPAC Name:
octadecane-2,3-diol
InChI:
InChI=1S/C18H38O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18(20)17(2)19/h17-20H,3-16H2,1-2H3
InChI Key:
QUADQLCGKXETIS-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCC(C(O)C)O
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.287g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
286.5g/mol
Monoisotopic Mass:
286.287g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
7.1
Literature
| Title | Journal |
|---|---|
| Identification of avian wax synthases. | BMC biochemistry 20120101 |
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