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1190-63-2 | Octadecanoic acid, hexadecyl ester
CAS No: 1190-63-2 Catalog No: AG000P0B MDL No:
Product Description
Catalog Number:
AG000P0B
Chemical Name:
Octadecanoic acid, hexadecyl ester
CAS Number:
1190-63-2
Molecular Formula:
C34H68O2
Molecular Weight:
508.9025
IUPAC Name:
hexadecyl octadecanoate
InChI:
InChI=1S/C34H68O2/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34(35)36-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h3-33H2,1-2H3
InChI Key:
SSZBUIDZHHWXNJ-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCCCCC
EC Number:
214-724-1
UNII:
06RI5UQA7L
Properties
Complexity:
406
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
508.522g/mol
Formal Charge:
0
Heavy Atom Count:
36
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
508.916g/mol
Monoisotopic Mass:
508.522g/mol
Rotatable Bond Count:
32
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
16.3
Literature
| Title | Journal |
|---|---|
| Immobilized Rhizopus oryzae lipase catalyzed synthesis of palm stearin and cetyl alcohol wax esters: optimization by response surface methodology. | BMC biotechnology 20110101 |
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