Anthranilic acid, N-(o-((difluoromethyl)thio)phenyl)-
Basic information
- CAS
51679-48-2- Standard SMILES
O=C(O)c1ccccc1Nc1ccccc1SC(F)F- InChIKey
YWIFZCBZACKCPP-UHFFFAOYSA-N- Molecular formula
- C14H11F2NO2S
- Average molar mass
- 295.31 g/mol
- Monoisotopic mass
- 295.04785609
Names & identifiers
- Preferred name
- Anthranilic acid, N-(o-((difluoromethyl)thio)phenyl)-
- IUPAC
- 2-[2-(difluoromethylsulfanyl)anilino]benzoic acid
Names & synonyms
BRN 2757270Anthranilic acid, N-(o-((difluoromethyl)thio)phenyl)-N-(o-((Difluoromethyl)thio)phenyl)anthranilic acid51679-48-2Benzoic acid, 2-((2-((difluoromethyl)thio)phenyl)amino)-DTXSID50199630RefChem:319839DTXCID10122121AKOS0128352362-{2-[(Difluoromethyl)sulfanyl]anilino}benzoic acid
Database identifiers
- CAS
51679-48-2- PubChem CID
- 3040102
- DTXSID
DTXSID50199630
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 330
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…