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4-(1H-Imidazol-1-yl)aniline

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Name

4-(1H-Imidazol-1-yl)aniline

EINECS N/A
CAS No. 2221-00-3 Density 1.2 g/cm3
PSA 43.84000 LogP 2.03570
Solubility N/A Melting Point 143-147 °C(lit.)
Formula C9H9N3 Boiling Point 355.4 °C at 760 mmHg
Molecular Weight 159.191 Flash Point 168.7 °C
Transport Information N/A Appearance off white powder
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 2221-00-3 (4-(1H-Imidazol-1-yl)aniline) Hazard Symbols IrritantXi
Synonyms

1-(p-Aminophenyl)imidazole;1-(4-Aminophenyl)imidazole;1-(4-Aminophenyl)-1H-imidazole;(4-Imidazolylphenyl)amine;4-(1H-Imidazol-1-yl)aniline;4-(1-Imidazolyl)aniline;4-(1H-Imidazol-1-yl)benzenamine;4-[Imidazol-1-yl]phenylamine;NSC 266462;Imidazole,1-(p-aminophenyl)- (7CI,8CI);

Article Data 49

4-(1H-Imidazol-1-yl)aniline Chemical Properties

IUPAC Name: 4-imidazol-1-ylaniline 
Empirical Formula: C9H9N3
Molecular Weight: 159.1879g/mol
Structure of 4-(1H-Imidazol-1-yl)aniline (CAS NO.2221-00-3):

Index of Refraction: 1.641
Molar Refractivity: 47.84 cm3
Molar Volume: 132.6 cm3
Polarizability: 18.96×10-24cm3
Surface Tension: 50.3 dyne/cm
Density: 1.2 g/cm3
Flash Point: 168.7 °C
Enthalpy of Vaporization: 60.05 kJ/mol 
Melting Point: 143-147 °C(lit.)
Boiling Point: 355.4 °C at 760 mmHg
Vapour Pressure: 3.15E-05 mmHg at 25°C 
Product Categories: pharmacetical;Imidazol&Benzimidazole;Heterocyclic Compounds;Amines;Phenyls & Phenyl-Het
Canonical SMILES: C1=CC(=CC=C1N)N2C=CN=C2
InChI: InChI=1S/C9H9N3/c10-8-1-3-9(4-2-8)12-6-5-11-7-12/h1-7H,10H2
InChIKey: LVOASPZGXNAHJI-UHFFFAOYSA-N

4-(1H-Imidazol-1-yl)aniline Safety Profile

Hazard Codes: IrritantXi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36:Wear suitable protective clothing.
WGK Germany: 3

4-(1H-Imidazol-1-yl)aniline Specification

  4-(1H-Imidazol-1-yl)aniline , its cas register number is 2221-00-3. It also can be called 4-(1H-imidazol-1-yl)phenylamine ; benzenamine, 4-(1H-imidazol-1-yl)- ; 1-(4-Aminophenyl)-1H-imidazole . 4-(1H-Imidazol-1-yl)aniline (CAS NO.2221-00-3) is irritating to eyes, respiratory system and skin.

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