Basic information
- CAS
76-82-4- Standard SMILES
Cc1cc(C(O)(c2ccc(N)cc2)c2ccc(N)cc2)ccc1N- InChIKey
OYHZNLZYIRSDHN-UHFFFAOYSA-N- Molecular formula
- C20H21N3O
- Average molar mass
- 319.4 g/mol
- Monoisotopic mass
- 319.1684623
Names & identifiers
- Preferred name
- C.I. Basic Violet 14, carbinol
- IUPAC
- (4-amino-3-methylphenyl)-bis(4-aminophenyl)methanol
- English name
- (4-amino-3-methyl-phenyl)-bis(4-aminophenyl)methanol
- Molecular formula
- C20H21N3O
- Molecular weight
- 319.4
Names & synonyms
C.I. Basic Violet 14, carbinol76-82-4Triamino-diphenyl-tolylcarbinolMethanol, bis(p-aminophenyl)(4-amino-m-tolyl)-SCHEMBL3355114DTXSID90226898OYHZNLZYIRSDHN-UHFFFAOYSA-N4-Amino-alpha,alpha-bis(4-aminophenyl)-3-methylbenzenemethanolBenzenemethanol, 4-amino-alpha,alpha-bis(4-aminophenyl)-3-methyl-(4-AMINO-3-METHYLPHENYL)BIS(4-AMINOPHENYL)METHANOL(4-amino-3-methyl-phenyl)-bis(4-aminophenyl)methanolBenzenemethanol, 4-amino-α,α-bis(4-aminophenyl)-3-methyl-
Database identifiers
- CAS
76-82-4- PubChem CID
- 66158
- DTXSID
DTXSID90226898
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 98.3 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 378
Physicochemical properties
- Boiling point
- 597.7 · 597.7±50.0 °C(Predicted)
- Density
- 1.26 · 1.260±0.06 g/cm3(Predicted)
- pka
- 13.79 · 13.79±0.29(Predicted)
- CAS DataBase Reference
- 76 · 76-82-4
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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