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3,4-bis(9-methyldecyl)phthalic acid

3,4-bis(9-methyldecyl)phthalic acid

Systemtic Name:3,4-bis(9-methyldecyl)phthalic acid
Openeye Name:3,4-bis(9-methyldecyl)phthalic acid
CAS Name:3,4-bis(9-methyldecyl)phthalic acid
IUPAC Name:3,4-bis(9-methyldecyl)phthalic acid
Traditional Name:3,4-bis(9-methyldecyl)phthalic acid
Formula: C30H50O4
MolecularWeight: 474.7156
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCC1=C(C(=C(C=C1)C(=O)O)C(=O)O)CCCCCCCCC(C)C


Isomeric SMILES

CC(C)CCCCCCCCC1=C(C(=C(C=C1)C(=O)O)C(=O)O)CCCCCCCCC(C)C


InChI

InChI=1S/C30H50O4/c1-23(2)17-13-9-5-7-11-15-19-25-21-22-27(29(31)32)28(30(33)34)26(25)20-16-12-8-6-10-14-18-24(3)4/h21-24H,5-20H2,1-4H3,(H,31,32)(H,33,34)


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