4-(4,6-Diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenol
Basic information
- CAS
74798-26-8- Standard SMILES
CC1(C)N=C(N)N=C(N)N1c1ccc(O)cc1- InChIKey
SJSNBTUQKPFFQU-UHFFFAOYSA-N- Molecular formula
- C11H15N5O
- Average molar mass
- 233.27 g/mol
- Monoisotopic mass
- 233.12766012
Names & identifiers
- Preferred name
- 4-(4,6-Diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenol
- IUPAC
- 4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenol
Names & synonyms
4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenolCHEMBL3415874798-26-8DTXSID00332434BDBM504050814-(4,6-Diamino-2,2-dimethyl-1,3,5-triazin-1(2H)-yl)phenol1-(4-Hydroxyphenyl)-1,6-dihydro-6,6-dimethyl-1, 3,5-triazine-2,4-diamine
Database identifiers
- CAS
74798-26-8- PubChem CID
- 456598
- DTXSID
DTXSID00332434- ChEMBL
CHEMBL34158- Nikkaji
- J566.792E
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 355
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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