Basic information
- CAS
3732-90-9- Standard SMILES
Cc1cc(N=Nc2ccccc2)ccc1N(C)C- InChIKey
FMDTUZFOCQKSFX-UHFFFAOYSA-N- Molecular formula
- C15H17N3
- Average molar mass
- 239.32 g/mol
- Monoisotopic mass
- 239.14224756
Names & identifiers
- Preferred name
- N,N,2-Trimethyl-4-(2-phenyldiazenyl)benzenamine
- IUPAC
- N,N,2-trimethyl-4-phenyldiazenylaniline
- English name
- 3METHYL4DIMETHYLAMINOAZOBENZENE(3-methylisomer)
- Molecular formula
- C15H17N3
- Molecular weight
- 239.32
Names & synonyms
3732-90-9N,N,2-TRIMETHYL-4-(2-PHENYLDIAZENYL)BENZENAMINERefChem:2018933-Methyl-4-dimethylaminoazobenzeneo-Toluidine, N,N-dimethyl-4-(phenylazo)-Benzenamine, N,N,2-trimethyl-4-(phenylazo)-659HNU0ZCT3-Methyl-4-DABBenzenamine, N,N,2-trimethyl-4-(2-phenyldiazenyl)-BRN 1842369UNII-659HNU0ZCTSCHEMBL3341207
Show more names
3,N,N-Trimethylazobenzen-4-amineN,N,2-Trimethyl-4-(phenylazo)anilineN,N,2-Trimethyl-4-(phenylazo)benzeneamine
SCHEMBL3341211DTXSID501038285N,N-DIMETHYL-4-AMINO-3-METHYLAZOBENZENE
Database identifiers
- CAS
3732-90-9- PubChem CID
- 77319
- DTXSID
DTXSID501038285- UNII
- 659HNU0ZCT
- Nikkaji
- J2.194F
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 28 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 269
Physicochemical properties
- Boiling point
- 371.98 °C · 371.98°C (rough estimate)
- Density
- 1.1092 · 1.1092 (rough estimate)
- refractive index
- 1.561 · 1.5610 (estimate)
- pka
- 3.82 · 3.820±0.18(predicted)
- FDA UNII
- 659 HNU0ZCT · 659HNU0ZCT
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…