Basic information
- CAS
119631-00-4- Standard SMILES
Cc1ccc(N=Nc2ccc(C)c(N)c2)cc1N- InChIKey
MOANQCLTXTXKAF-UHFFFAOYSA-N- Molecular formula
- C14H16N4
- Average molar mass
- 240.3 g/mol
- Monoisotopic mass
- 240.13749653
Names & identifiers
- Preferred name
- 3,3'-Diamino-4,4'-dimethylazobenzene
- IUPAC
- 5-[(3-amino-4-methylphenyl)diazenyl]-2-methylaniline
- English name
- 33DIAMINO44DIMETHYLAZOBENZENE
- Molecular formula
- C14H16N4
- Molecular weight
- 240.3
Names & synonyms
3,3'-Diamino-4,4'-dimethylazobenzene119631-00-4Benzenamine, 3,3'-azobis(6-methyl-CCRIS 3005Benzenamine, 3,3'-azobis[6-methyl-5-[(3-amino-4-methylphenyl)diazenyl]-2-methylaniline3,3'-Azobis(6-methylbenzenamine)BRN 3316567XH2A957FMC2-16-00-00178 (Beilstein Handbook Reference)o-Toluidine, 5,5'-azobis-SCHEMBL28233514
Show more names
33DIAMINO44DIMETHYLAZOBENZENEBenzenamine, 3,3'-azobis[6-methyl- (9CI)
SCHEMBL28233516DTXSID8010279803,3'-Diazenediylbis(6-methylaniline)
Database identifiers
- CAS
119631-00-4- PubChem CID
- 147449
- DTXSID
DTXSID801027980- UNII
- XH2A957FMC
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 76.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 264
Physicochemical properties
- Boiling point
- 479.6 · 479.6±45.0 °C(Predicted)
- Density
- 1.18 · 1.18±0.1 g/cm3(Predicted)
- pka
- 3.83 · 3.83±0.10(Predicted)
- EWG's Food Scores
- 1 · 1
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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