Basic information
- CAS
104766-03-2- Standard SMILES
N=c1nc(-c2cc(Cl)ccc2Cl)nc(N)n1O- InChIKey
UZRHHBIKNCZGGJ-UHFFFAOYSA-N- Molecular formula
- C9H7Cl2N5O
- Average molar mass
- 272.09 g/mol
- Monoisotopic mass
- 271.0027653
Names & identifiers
- Preferred name
- 4-(2,5-Dichlorophenyl)-2,6-diimino-3,6-dihydro-1,3,5-triazin-1(2H)-ol
- IUPAC
- 4-(2,5-dichlorophenyl)-1-hydroxy-6-imino-1,3,5-triazin-2-amine
Names & synonyms
DTXSID509091954-(2,5-Dichlorophenyl)-2,6-diimino-3,6-dihydro-1,3,5-triazin-1(2H)-olRefChem:1069759DTXCID101338261104766-03-2MN-1695 N-Oxide2,4-Diamino-6-(2,5-dichlorophenyl)-s-triazine 3-oxides-Triazine, 2,6-diamino-4-(2,5-dichlorophenyl)-, 1-oxide1,3,5-Triazine-2,4-diamine, 6-(2,5-dichlorophenyl)-, 3-oxide
Database identifiers
- CAS
104766-03-2- PubChem CID
- 149668
- DTXSID
DTXSID50909195
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 98.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 397
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…