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2,2-bis(2-fluoranyl-2-pentyl-tetradecyl)butanedioic acid

2,2-bis(2-fluoranyl-2-pentyl-tetradecyl)butanedioic acid

Systemtic Name:2,2-bis(2-fluoranyl-2-pentyl-tetradecyl)butanedioic acid
Openeye Name:2,2-bis(2-fluoro-2-pentyl-tetradecyl)butanedioic acid
CAS Name:2,2-bis(2-fluoro-2-pentyltetradecyl)butanedioic acid
IUPAC Name:2,2-bis(2-fluoro-2-pentyltetradecyl)butanedioic acid
Traditional Name:2,2-bis(2-amyl-2-fluoro-tetradecyl)succinic acid
Formula: C42H80F2O4
MolecularWeight: 687.079006
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCCCC)(CC(CC(=O)O)(CC(CCCCC)(CCCCCCCCCCCC)F)C(=O)O)F


Isomeric SMILES

CCCCCCCCCCCCC(CCCCC)(CC(CC(=O)O)(CC(CCCCC)(CCCCCCCCCCCC)F)C(=O)O)F


InChI

InChI=1S/C42H80F2O4/c1-5-9-13-15-17-19-21-23-25-29-33-41(43,31-27-11-7-3)36-40(39(47)48,35-38(45)46)37-42(44,32-28-12-8-4)34-30-26-24-22-20-18-16-14-10-6-2/h5-37H2,1-4H3,(H,45,46)(H,47,48)


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