4-Phenyl-6-(trifluoromethyl)pyrimidin-2-amine
Basic information
- CAS
26974-09-4- Standard SMILES
Nc1nc(-c2ccccc2)cc(C(F)(F)F)n1- InChIKey
ZHXBPRJAAQLLMC-UHFFFAOYSA-N- Molecular formula
- C11H8F3N3
- Average molar mass
- 239.2 g/mol
- Monoisotopic mass
- 239.06703175
Names & identifiers
- Preferred name
- 4-Phenyl-6-(trifluoromethyl)pyrimidin-2-amine
- IUPAC
- 4-phenyl-6-(trifluoromethyl)pyrimidin-2-amine
- English name
- 2-Amino-4-phenyl-6-(trifluoromethyl)pyrimidine
- Molecular formula
- C11H8F3N3
- Molecular weight
- 239.2
Names & synonyms
26974-09-44-phenyl-6-(trifluoromethyl)pyrimidin-2-amineDTXSID20347040RefChem:295500DTXCID502981122-Amino-4-phenyl-6-(trifluoromethyl)pyrimidineMFCD001604614-Phenyl-6-(trifluoromethyl)-2-pyrimidinylamine4-phenyl-6-(trifluoromethyl)pyrimidine-2-ylamineCDS1_000322Maybridge1_0026104-(Trifluoromethyl)-6-phenylpyrimidin-2-amine
Show more names
AKOS BBS-000003874-phenyl-6-(trifluoromethyl)-2-pyrimidinamine2-Amino-4-phenyl-6-(trifluoromethyl)pyrimidne4-Phenyl-6-(trifluoromethyl)pyrimidine-2-amine2-Pyrimidinamine, 4-phenyl-6-(trifluoromethyl)-2-Amino-4-phenyl-6-(trifluoromethyl)pyrimidine97%
2-Pyrimidinamine,4-phenyl-6-(trifluoromethyl)-MLS000087459DivK1c_001362Pyrimidine, 2-amino-4-phenyl-6-(trifluoromethyl)-SCHEMBL2991593CHEMBL1572148HMS548O14HMS2440C10
Database identifiers
- CAS
26974-09-4- PubChem CID
- 617433
- DTXSID
DTXSID20347040- ChEMBL
CHEMBL1572148- Nikkaji
- J99.833H
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 251
Physicochemical properties
- Melting point
- 131 · 131-133
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301
- Precautionary statements
- 264 · P264-P270-P301+P310+P330-P405-P501
- Hazard Codes
- Xi,T
- Risk Statements
- 36 · 36/37/38-25
- Safety Statements
- 26 · 26-36/37/39-45-24/25
- Hazard Note
- Irritant
- HS Code
- 29335990 · 29335990
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
- hs_code
- 29335990
- risk_code
- 36/37/38-25
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- hazard_code
- Xi,T
- hazard_note
- Irritant
- safety_code
- 26-36/37/39-45-24/25
- Hazard statements
- H301
- Precautionary statements
- P264-P270-P301+P310+P330-P405-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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