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2-chloroethylphosphonic acid; octadecanoyl octadecanoate

2-chloroethylphosphonic acid; octadecanoyl octadecanoate

Systemtic Name:2-chloroethylphosphonic acid; octadecanoyl octadecanoate
Openeye Name:2-chloroethylphosphonic acid; octadecanoyl octadecanoate
CAS Name:2-chloroethylphosphonic acid; octadecanoic acid 1-oxooctadecyl ester
IUPAC Name:2-chloroethylphosphonic acid; octadecanoyl octadecanoate
Traditional Name:2-chloroethylphosphonic acid; stearic acid stearoyl ester
Formula: C38H76ClO6P
MolecularWeight: 695.433201
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC(=O)CCCCCCCCCCCCCCCCC.C(CCl)P(=O)(O)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC(=O)CCCCCCCCCCCCCCCCC.C(CCl)P(=O)(O)O


InChI

InChI=1S/C36H70O3.C2H6ClO3P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35(37)39-36(38)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;3-1-2-7(4,5)6/h3-34H2,1-2H3;1-2H2,(H2,4,5,6)


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