2-Chloro-6-(trifluoromethyl)pyrimidine-4,5-diamine
Basic information
- CAS
708-46-3- Standard SMILES
Nc1nc(Cl)nc(C(F)(F)F)c1N- InChIKey
VKQHUGOEOGTPAI-UHFFFAOYSA-N- Molecular formula
- C5H4ClF3N4
- Average molar mass
- 212.56 g/mol
- Monoisotopic mass
- 212.0076583
Names & identifiers
- Preferred name
- 2-Chloro-6-(trifluoromethyl)pyrimidine-4,5-diamine
- IUPAC
- 2-chloro-6-(trifluoromethyl)pyrimidine-4,5-diamine
- English name
- 2-Chloro-6-(trifluoromethyl)pyrimidine-4,5-diamine
- Molecular formula
- C5H4ClF3N4
- Molecular weight
- 212.56
Names & synonyms
2-chloro-6-(trifluoromethyl)pyrimidine-4,5-diamine708-46-3NSC57026SCHEMBL31224694DTXSID50288639AAA70846NSC 57026NSC-57026AKOS000320366DS-013121CS-0235775EN300-1608758
Show more names
4,5-diamino-2-chloro-6-trifluoromethylpyrimidine
Database identifiers
- CAS
708-46-3- PubChem CID
- 245274
- DTXSID
DTXSID50288639- EC Number
- 883-197-3
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 77.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 187
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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