Basic information
- CAS
76765-44-1- Standard SMILES
Cc1ccc(C(=O)N(C2CCCCC2)C2CCCCC2)cc1N=NN(C)C- InChIKey
VXTBXWJLIXAJTA-UHFFFAOYSA-N- Molecular formula
- C22H34N4O
- Average molar mass
- 370.5 g/mol
- Monoisotopic mass
- 370.27326172
Names & identifiers
- Preferred name
- N,N-Dicyclohexyl-3-(3,3-dimethyltriazeno)-p-toluamide
- IUPAC
- N,N-dicyclohexyl-3-(dimethylaminodiazenyl)-4-methylbenzamide
- English name
- p-Toluamide, N,N-dicyclohexyl-3-(3,3-dimethyltriazeno)-
- Molecular formula
- C22H34N4O
- Molecular weight
- 370.53
Names & synonyms
76765-44-1NSC651348N,N-Dicyclohexyl-3-(3,3-dimethyltriazeno)-p-toluamideN,N-Dicyclohexyl-3-(3,3-dimethyl-1-triazenyl)-4-methylbenzamideCHEMBL1985471p-Toluamide, N,N-dicyclohexyl-3-(3,3-dimethyltriazeno)-Benzamide, N,N-dicyclohexyl-3-(3,3-dimethyl-1-triazeno)-4-methyl-NSC-651348NCI60_017942N,N-dicyclohexyl-3-[(E)-dimethylaminoazo]-4-methyl-benzamide
Database identifiers
- CAS
76765-44-1- PubChem CID
- 374088
- ChEMBL
CHEMBL1985471
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 48.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 477
Physicochemical properties
- Melting point
- 119 · 119-120 °C
- Boiling point
- 531.25 · 531.250±60.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.134 · 1.134±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 1.072 · 1.072±0.70(predicted)
- EWG's Food Scores
- 1 · 1
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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