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| CAS No.: | 17010-59-2 |
|---|---|
| Name: | 4-[(4-Chloro-3-methylphenyl)azo]-N,N-dimethylbenzenamine |
| Molecular Structure: | |
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| Formula: | C15H16 Cl N3 |
| Molecular Weight: | 273.79 |
| Synonyms: | Aniline,p-[(4-chloro-m-tolyl)azo]-N,N-dimethyl- (8CI); Benzenamine,4-[(4-chloro-3-methylphenyl)azo]-N,N-dimethyl- (9CI);3'-Methyl-4'-chloro-4-(dimethylamino)azobenzene |
| Density: | 1.12g/cm3 |
| Boiling Point: | 419.5°Cat760mmHg |
| Flash Point: | 207.5°C |
| Safety: | Questionable carcinogen with experimental carcinogenic and tumorigenic data. When heated to decomposition it emits toxic fumes of Cl− and NOx. |
| PSA: | 27.96000 |
| LogP: | 5.12980 |
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Chemistry
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IUPAC: 4-(4-chloro-3-methylphenyl)diazenyl-N,N-dimethylaniline
Molecular Formula: C15H16ClN3
Canonical SMILES: CC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)N(C)C)Cl
InChI: InChI=1S/C15H16ClN3/c1-11-10-13(6-9-15(11)16)18-17-12-4-7-14(8-5-12)19(2)3/h4-10H,1-3H3
Molecular Weight: 273.760640 g/mol
Mol File: 17010-59-2.mol
Classification Code: Tumor data
XLogP3-AA: 4.8
H-Bond Acceptor: 3
Rotatable Bond Count: 3
Exact Mass: 273.103275
MonoIsotopic Mass: 273.103275
Topological Polar Surface Area: 28
Heavy Atom Count: 19
Complexity: 298
Index of Refraction: 1.575
Molar Refractivity: 80.68 cm3
Molar Volume: 243.9 cm3
Polarizability: 31.98×10-24cm3
Surface Tension: 37.5 dyne/cm
Density: 1.12 g/cm3
Flash Point: 207.5 °C
Enthalpy of Vaporization: 67.32 kJ/mol
Boiling Point: 419.5 °C at 760 mmHg
Vapour Pressure of Aniline, p-((4-chloro-m-tolyl)azo-N,N-dimethyl- (CAS NO.17010-59-2): 3.02E-07 mmHg at 25 °C
Safety Profile
Questionable carcinogen with experimental carcinogenic and tumorigenic data. When heated to decomposition Aniline, p-((4-chloro-m-tolyl)azo-N,N-dimethyl- (CAS NO.17010-59-2) emits toxic fumes of Cl− and NOx.
Specification
Aniline, p-((4-chloro-m-tolyl)azo-N,N-dimethyl- (CAS NO.17010-59-2) can be called 4'-Chloro-3'-methyl-4-dimethylaminoazobenzene ; Aniline, N,N-dimethyl-p-(4'-chloro-3'-methylphenylazo)- ; N,N-Dimethyl-p-((4-chloro-m-tolyl)azo)aniline ; p-((4-Chloro-m-tolyl)azo)-N,N-dimethylaniline and so on.