Basic information
- CAS
4022-58-6- Standard SMILES
CC1(C)N=C(N)N=C(N)N1c1ccccc1- InChIKey
VMVKLCXTXSSZSI-UHFFFAOYSA-N- Molecular formula
- C11H15N5
- Average molar mass
- 217.27 g/mol
- Monoisotopic mass
- 217.1327455
Overview
structure in first source
Names & identifiers
- Preferred name
- 4,6-Diamino-2,2-dimethyl-1,2-dihydro-1-phenyl-s-triazine
- IUPAC
- 6,6-dimethyl-1-phenyl-1,3,5-triazine-2,4-diamine
- English name
- 1,6-Dihydro-6,6-dimethyl-1-phenyl-s-triazine-2,4-diamine
- Molecular formula
- C11H15N5
- Molecular weight
- 217.27
Names & synonyms
4,6-diamino-2,2-dimethyl-1,2-dihydro-1-phenyl-s-triazineRefChem:9119064,6-DADM-PT4022-58-61,3,5-Triazine-2,4-diamine, 1,6-dihydro-6,6-dimethyl-1-phenyl-6,6-dimethyl-1-phenyl-1,3,5-triazine-2,4-diamine31YM8O4QFTCHEMBL67424,6-diamino-1,2-dihydro-2,2-dimethyl-1-phenyl-s-triazine6,6-dimethyl-1-phenyl-1,6-dihydro-1,3,5-triazine-2,4-diamine1,6-Dihydro-6,6-dimethyl-1-phenyl-s-triazine-2,4-diamineChemDiv3_004519
Show more names
6,6-dimethyl-1-phenyl-1,6-dihydro-[1,3,5]triazine-2,4-diamine
UNII-31YM8O4QFTGNF-Pf-3611SCHEMBL1938185DTXSID30193217HMS1485N09BDBM50090067EBC-770321,6-DIHYDRO-6,6-DIMETHYL-1-PHENYL-1,3,5-TRIAZINE-2,4-DIAMINE
Database identifiers
- CAS
4022-58-6- PubChem CID
- 19931
- DTXSID
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 80 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 325
Experimental & physicochemical properties
LogP0.28
Physicochemical properties
- FDA UNII
- 31 YM8O4QFT · 31YM8O4QFT
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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