Methyl 2-amino-4-(trifluoromethyl)pyrimidine-5-carboxylate
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Basic information
- CAS
448242-52-2- Standard SMILES
COC(=O)c1cnc(N)nc1C(F)(F)F- InChIKey
QJQMINFLRJGFDC-UHFFFAOYSA-N- Molecular formula
- C7H6F3N3O2
- Average molar mass
- 221.14 g/mol
- Monoisotopic mass
- 221.04121093
Names & identifiers
- Preferred name
- Methyl 2-amino-4-(trifluoromethyl)pyrimidine-5-carboxylate
- IUPAC
- methyl 2-amino-4-(trifluoromethyl)pyrimidine-5-carboxylate
- English name
- METHYL 2-AMINO-4-(TRIFLUOROMETHYL)PYRIMIDINE-5-CARBOXYLATE
- Molecular formula
- C7H6F3N3O2
- Molecular weight
- 221.14
Names & synonyms
Methyl 2-amino-4-(trifluoromethyl)pyrimidine-5-carboxylate448242-52-2Maybridge3_001676SCHEMBL15038313DTXSID20384576QJQMINFLRJGFDC-UHFFFAOYSA-NHMS1435M04AKOS022172769SB58482IDI1_013063EN300-9452698Methyl2-amino-4-(trifluoromethyl)pyrimidine-5-carboxylate
Show more names
5-Pyrimidinecarboxylic acid, 2-amino-4-(trifluoromethyl)-, methyl ester
Database identifiers
- CAS
448242-52-2- PubChem CID
- 2808528
- DTXSID
DTXSID20384576
Properties
Computed structural propertiesFilling in
- XLogP
- 0.6
- Topological polar surface area
- 78.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 246
Physicochemical properties
- storage temp.
- 2 · 2-8°C
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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