Basic information
- Standard SMILES
Nc1ccc(Oc2c(F)c(F)c(-c3c(F)c(F)c(Oc4ccc(C(=O)O)cc4)c(F)c3F)c(F)c2F)cc1O- InChIKey
FWBRAFSACZYPEL-UHFFFAOYSA-N- Molecular formula
- C25H11F8NO5
- Average molar mass
- 557.3 g/mol
Names & identifiers
- Preferred name
- 4-(4-Amino-3-hydroxyphenoxy)4'-(4-carboxyphenoxy)octafluorobiphenyl
- IUPAC
- 4-[4-[4-(4-amino-3-hydroxyphenoxy)-2,3,5,6-tetrafluorophenyl]-2,3,5,6-tetrafluorophenoxy]benzoic acid
Names & synonyms
SCHEMBL7658168FWBRAFSACZYPEL-UHFFFAOYSA-N4-(4-amino-3-hydroxyphenoxy)4'-(4-carboxyphenoxy)octafluorobiphenyl4- (4-amino-3-hydroxyphenoxy)4'-(4-carboxyphenoxy)octafluorobiphenyl4-(4-amino-3-hydroxyphenoxy)-4'-(4-carboxyphenoxy)-octafluorobiphenyl
Database identifiers
- PubChem CID
- 11049973
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 14
- Rotatable bonds
- 6
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 808
Related reactions
3 records
Compound notes
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