Basic information
- CAS
331760-41-9- Standard SMILES
O=C(O)c1ccc(-c2ccc(F)cc2F)cc1- InChIKey
DGHGRAZWNAQANC-UHFFFAOYSA-N- Molecular formula
- C13H8F2O2
- Average molar mass
- 234.2 g/mol
- Monoisotopic mass
- 234.04923582
Names & identifiers
- Preferred name
- 4-(2,4-difluorophenyl)benzoic Acid
- IUPAC
- 4-(2,4-difluorophenyl)benzoic acid
- English name
- 4-(2,4-Difluorophenyl)benzoic acid
- Molecular formula
- C13H8F2O2
- Molecular weight
- 234.2
Names & synonyms
331760-41-94-(2,4-difluorophenyl)benzoic AcidDTXSID30374246RefChem:286899DTXCID703252772',4'-difluoro-[1,1'-biphenyl]-4-carboxylic acid2',4'-Difluoro-biphenyl-4-carboxylic acid2',4'-difluorobiphenyl-4-carboxylic acidMFCD041173862',4'-Difluoro-4-Biphenylcarboxylic Acid2',4'-difluoro[1,1'-biphenyl]-4-carboxylic acidSCHEMBL411705
Show more names
2′,4′-Difluoro-biphenyl-4-carboxylic acid, CAS 331760-41-94-Carboxy-2',4'-difluorobiphenyl, 4-(2,4-Difluorophenyl)benzoic acid
2',4'-Difluoro-[1,1'-biphenyl]-4-carboxylicacidCHEMBL122035DGHGRAZWNAQANC-UHFFFAOYSA-NSBB098227AKOS006123951AB92542PS-7668DB-262542
Database identifiers
- CAS
331760-41-9- PubChem CID
- 2758264
- DTXSID
DTXSID30374246- ChEMBL
CHEMBL122035- EC Number
- 673-776-7
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 275
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H319-H315
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
- HS Code
- 2916399090 · 2916399090
Safety & regulation
Safety data
- hs_code
- 2916399090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H319-H315
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers6 total
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
12 records
Compound notes
Loading…