Basic information
- CAS
22978-42-3- Standard SMILES
O=C(Nc1ccccc1)c1ccccc1C(F)(F)F- InChIKey
ZKPGLQPSAPAFAP-UHFFFAOYSA-N- Molecular formula
- C14H10F3NO
- Average molar mass
- 265.23 g/mol
- Monoisotopic mass
- 265.07144843
Names & identifiers
- Preferred name
- N-phenyl-2-(trifluoromethyl)benzamide
- IUPAC
- N-phenyl-2-(trifluoromethyl)benzamide
- English name
- N-Phenyl-2-(trifluoroMethyl)benzaMide, 97%
- Molecular formula
- C14H10F3NO
- Molecular weight
- 265.23
Names & synonyms
N-Phenyl-2-(Trifluoromethyl)benzamide22978-42-3RefChem:830935668-943-62-TRIFLUOROMETHYLBENZANILIDE2-(Trifluoromethyl)benzanilideSCHEMBL2518885SCHEMBL5332281CHEMBL1615252ZKPGLQPSAPAFAP-UHFFFAOYSA-NMFCD00045073AKOS001422730
Show more names
Benzamide, N-phenyl-2-(trifluoromethyl)-N-Phenyl-2-(trifluoroMethyl)benzaMide, 97%
DB-347345AO-854/42911664Q27466238Z27782642TFZ
Database identifiers
- CAS
22978-42-3- PubChem CID
- 3321744
- ChEMBL
CHEMBL1615252- EC Number
- 668-943-6
- Nikkaji
- J3.152.634E
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 310
Physicochemical properties
- Melting point
- 151 · 151-152 °C
- Boiling point
- 274.7 · 274.7±40.0 °C(Predicted)
- Density
- 1.314 · 1.314±0.06 g/cm3(Predicted)
- pka
- 12.87 · 12.87±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 317 · H317-H302-H319
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P280-P305+P351+P338-P337+P313P
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P261, P264, P264+P265, P270, P272, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P333+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 66 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)；Skin Sens. 1 (100%)；Eye Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H317-H302-H319
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers8 total
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
郑州为易化工产品有限公司0371-88888888 qq272369594;2159423853qq · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
江苏新素新材料有限公司0512-66387919 15251950002 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
1 records
Compound notes
Loading…