Basic information
- Standard SMILES
O=C(O)c1ccc(-c2ccc(OCCCCCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c(F)c2F)cc1- InChIKey
NGAYVIFPVFMPQG-UHFFFAOYSA-N- Molecular formula
- C23H19F11O3
- Average molar mass
- 552.4 g/mol
Names & identifiers
- Preferred name
- 2',3'-Difluoro-4'-(7,7,8,8,9,9,10,10,10-nonafluoro-decyloxy)-biphenyl-4-carboxylic Acid
- IUPAC
- 4-[2,3-difluoro-4-(7,7,8,8,9,9,10,10,10-nonafluorodecoxy)phenyl]benzoic acid
Names & synonyms
2',3'-Difluoro-4'-(7,7,8,8,9,9,10,10,10-nonafluoro-decyloxy)-biphenyl-4-carboxylic AcidSCHEMBL6749716
Database identifiers
- PubChem CID
- 20632152
Properties
Computed structural properties
- XLogP
- 8.3
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 14
- Rotatable bonds
- 12
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 736
Related reactions
2 records
Compound notes
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