Basic information
- CAS
6890-83-1- Standard SMILES
O=C(O)C(=O)Nc1cccc(C(F)(F)F)c1- InChIKey
OJNUJHKAPNSODC-UHFFFAOYSA-N- Molecular formula
- C9H6F3NO3
- Average molar mass
- 233.14 g/mol
- Monoisotopic mass
- 233.02997754
Names & identifiers
- Preferred name
- N-(3-Trifluoromethyl-phenyl)-oxalamic acid
- IUPAC
- 2-oxo-2-[3-(trifluoromethyl)anilino]acetic acid
- English name
- N-(3-Trifluoromethyl-phenyl)-oxalamic acid
- Molecular formula
- C9H6F3NO3
- Molecular weight
- 233.14
Names & synonyms
6890-83-1N-(3-Trifluoromethyl-phenyl)-oxalamic acid2-Oxo-2-((3-(trifluoromethyl)phenyl)amino)acetic acid2-oxo-2-[3-(trifluoromethyl)anilino]acetic acid{[3-(TRIFLUOROMETHYL)PHENYL]CARBAMOYL}FORMIC ACID([3-(TRIFLUOROMETHYL)PHENYL]CARBAMOYL)FORMIC ACIDMFCD06740190N-(3-Trifluoromethylphenyl)oxalamic acidSCHEMBL2295426GAA89083EN300-331908G40580
Show more names
2-Oxo-2-((3-(trifluoromethyl)phenyl)amino)aceticacid2-oxo-2-(3-(trifluoromethyl)phenylamino)acetic acid
Database identifiers
- CAS
6890-83-1- PubChem CID
- 7183000
- EC Number
- 117-445-2
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 290
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers1 total
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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