Basic information
- CAS
30362-19-7- Standard SMILES
CCOC(=O)c1nc(N)nc(C(Cl)(Cl)Cl)n1- InChIKey
OBRMNGGSPAAIAC-UHFFFAOYSA-N- Molecular formula
- C7H7Cl3N4O2
- Average molar mass
- 285.5 g/mol
- Monoisotopic mass
- 283.963459
Names & identifiers
- Preferred name
- Ethyl 4-amino-6-(trichloromethyl)-1,3,5-triazine-2-carboxylate
- IUPAC
- ethyl 4-amino-6-(trichloromethyl)-1,3,5-triazine-2-carboxylate
Names & synonyms
30362-19-7ethyl 4-amino-6-(trichloromethyl)-1,3,5-triazine-2-carboxylateDTXSID60275237
Database identifiers
- CAS
30362-19-7- PubChem CID
- 35173
- DTXSID
DTXSID60275237- Nikkaji
- J1.613.735I
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 91 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 261
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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