Basic information
- CAS
104813-26-5- Standard SMILES
Nc1nc(N)nc(-c2cc(Cl)c(O)cc2Cl)n1- InChIKey
PTLPCSHTIPJFNT-UHFFFAOYSA-N- Molecular formula
- C9H7Cl2N5O
- Average molar mass
- 272.09 g/mol
- Monoisotopic mass
- 271.0027653
Names & identifiers
- Preferred name
- 4-(4,6-Diamino-s-triazinyl)-2,5-dichlorophenol
- IUPAC
- 2,5-dichloro-4-(4,6-diamino-1,3,5-triazin-2-yl)phenol
- English name
- 4-(4,6-Diamino-s-triazinyl)-2,5-dichlorophenol
- Molecular weight
- 0
Names & synonyms
104813-26-54-(4,6-Diamino-s-triazinyl)-2,5-dichlorophenolMN-1695, p-HydroxyPhenol, 4-(4,6-diamino-s-triazinyl)-2,5-dichloro-2,4-Diamino-6-(2,5-dichloro-4-hydroxyphenyl)-s-triazines-Triazine, 2,4-diamino-6-(2,5-dichloro-4-hydroxyphenyl)-Phenol, 2,5-dichloro-4-(4,6-diamino-1,3,5-triazin-2-yl)-2,5-dichloro-4-(4,6-diamino-1,3,5-triazin-2-yl)phenolDTXSID909092302,5-Dichloro-4-(4,6-diimino-1,3,5-triazinan-2-ylidene)cyclohexa-2,5-dien-1-one
Database identifiers
- CAS
104813-26-5- PubChem CID
- 149671
- DTXSID
DTXSID90909230
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 262
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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