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2,5-bis(14-methylpentadecyl)hexanedioic acid

2,5-bis(14-methylpentadecyl)hexanedioic acid

Systemtic Name:2,5-bis(14-methylpentadecyl)hexanedioic acid
Openeye Name:2,5-bis(14-methylpentadecyl)hexanedioic acid
CAS Name:2,5-bis(14-methylpentadecyl)hexanedioic acid
IUPAC Name:2,5-bis(14-methylpentadecyl)hexanedioic acid
Traditional Name:2,5-bis(14-methylpentadecyl)adipic acid
Formula: C38H74O4
MolecularWeight: 594.99176
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCCC(CCC(CCCCCCCCCCCCCC(C)C)C(=O)O)C(=O)O


Isomeric SMILES

CC(C)CCCCCCCCCCCCCC(CCC(CCCCCCCCCCCCCC(C)C)C(=O)O)C(=O)O


InChI

InChI=1S/C38H74O4/c1-33(2)27-23-19-15-11-7-5-9-13-17-21-25-29-35(37(39)40)31-32-36(38(41)42)30-26-22-18-14-10-6-8-12-16-20-24-28-34(3)4/h33-36H,5-32H2,1-4H3,(H,39,40)(H,41,42)


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