Identification | More | [Name]
4-(DIMETHYLAMINO)BENZONITRILE | [CAS]
1197-19-9 | [Synonyms]
1-CYANO-4-(DIMETHYLAMINO)BENZENE 4-CYANO-N,N-DIMETHYLANILINE 4-(DIMETHYLAMINO)BENZONITRILE AKOS B004059 LABOTEST-BB LT00233151 P-(DIMETHYLAMINO)BENZONITRILE TIMTEC-BB SBB008018 4-(Dimethylamino)benzenecarbonitrile Benzonitrile, p-(dimethylamino)- Benzonitrile,4-(dimethylamino)- N,N-Dimethyl-4-cyanoaniline N,N-Dimethyl-p-cyanoaniline p-(Dimethylamino)benzoic acid nitrile p-(N,N-Dimethylamino)benzonitrile para(Dimethylamino)benzonitrile p-Cyano-N,N-dimethylaniline 4-CYANODIMETHYLANILINE | [EINECS(EC#)]
214-819-8 | [Molecular Formula]
C9H10N2 | [MDL Number]
MFCD00001815 | [Molecular Weight]
146.19 | [MOL File]
1197-19-9.mol |
Chemical Properties | Back Directory | [Appearance]
light brown crystalline powder | [Melting point ]
72-75 °C(lit.)
| [Boiling point ]
318 °C(lit.)
| [density ]
1.3346 (rough estimate) | [refractive index ]
1.5600 (estimate) | [Fp ]
317-319°C | [solubility ]
soluble in Methanol | [form ]
Crystalline Powder | [pka]
1.61±0.12(Predicted) | [color ]
Light brown | [BRN ]
971606 | [InChI]
InChI=1S/C9H10N2/c1-11(2)9-5-3-8(7-10)4-6-9/h3-6H,1-2H3 | [InChIKey]
JYMNQRQQBJIMCV-UHFFFAOYSA-N | [SMILES]
C(#N)C1=CC=C(N(C)C)C=C1 | [CAS DataBase Reference]
1197-19-9(CAS DataBase Reference) | [EPA Substance Registry System]
Benzonitrile, 4-(dimethylamino)- (1197-19-9) |
Safety Data | Back Directory | [Hazard Codes ]
Xn,Xi | [Risk Statements ]
R22:Harmful if swallowed. R36/37/38:Irritating to eyes, respiratory system and skin . R43:May cause sensitization by skin contact. | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice . S36/37:Wear suitable protective clothing and gloves . S36:Wear suitable protective clothing . | [RIDADR ]
3276 | [WGK Germany ]
2
| [HazardClass ]
6.1 | [PackingGroup ]
III | [HS Code ]
29269090 |
Hazard Information | Back Directory | [Chemical Properties]
light brown crystalline powder | [Uses]
4-(Dimethylamino)benzonitrile is used in predicting the carcinogenicity of aromatic amine derivative in UK EMS collaborative study. | [Synthesis Reference(s)]
Tetrahedron Letters, 36, p. 4035, 1995 DOI: 10.1016/0040-4039(95)00710-T | [General Description]
4-(Dimethylamino)benzonitrile is extensively used in photophysical studies due to its ability to undergo intramolecular charge transfer (ICT) from the dimethylamino moiety to the cyanophenyl moiety on photo-excitation leading to the appearance of dual fluorescence. |
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