Basic information
- CAS
402714-65-2- Standard SMILES
O=C(O)c1ccccc1Oc1ccc(C(F)(F)F)cc1- InChIKey
JGAFZZORINPDFU-UHFFFAOYSA-N- Molecular formula
- C14H9F3O3
- Average molar mass
- 282.21 g/mol
- Monoisotopic mass
- 282.05037863
Names & identifiers
- Preferred name
- 2-[4-(trifluoromethyl)phenoxy]benzoic Acid
- IUPAC
- 2-[4-(trifluoromethyl)phenoxy]benzoic acid
- English name
- 2-[4-(Trifluoromethyl)phenoxy]benzoic acid
- Molecular formula
- C14H9F3O3
- Molecular weight
- 282.21
Names & synonyms
2-[4-(trifluoromethyl)phenoxy]benzoic Acid402714-65-2MFCD038400262-(4-Trifluoromethylphenoxy)benzoic acid2-(4-(Trifluoromethyl)phenoxy)benzoicacid2-[4-(trifluoromethyl)phenoxy]benzoicAcidAR1187SCHEMBL9138387DTXSID40395124JGAFZZORINPDFU-UHFFFAOYSA-NAKOS011515038FT53144
Show more names
Benzoic acid, 2-[4-(trifluoromethyl)phenoxy]-
AS-45051CS-0171187F305956
Database identifiers
- CAS
402714-65-2- PubChem CID
- 3692283
- DTXSID
DTXSID40395124
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 335
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Suppliers4 total
凯试（上海）科技有限公司021-50135380 · [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]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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