CAS No.6523-49-5,1-(4'-Aminophenyl)-1,2,4-triazole Suppliers

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Basic Information

Molecular Structure:
CAS No.:	6523-49-5
Name:	1-(4'-Aminophenyl)-1,2,4-triazole
Article Data:	9

Formula:	C₈H₈N₄
Molecular Weight:	160.178
Synonyms:	1H-1,2,4-Triazole,1-(p-aminophenyl)- (7CI,8CI);1-(4-Aminophenyl)-1,2,4-triazole;1-(p-Aminophenyl)-1H-1,2,4-triazole;1-p-Aminophenyl-1,2,4-triazole;4-(1H-1,2,4-Triazol-1-yl)aniline;4-(1H-1,2,4-Triazol-1-yl)benzenamine;4-([1,2,4]Triazol-1-yl)aniline;[4-([1,2,4]Triazol-1-yl)phenyl]amine;
Density:	1.32g/cm³
Melting Point:	142 °C
Boiling Point:	375.3 °C at 760 mmHg
Flash Point:	180.8 °C
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36/37/39
PSA:	56.73000
LogP:	1.43070

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Specification

The 1-(4'-Aminophenyl)-1,2,4-triazole, with CAS registry number 6523-49-5, has the systematic name of 4-(1H-1,2,4-triazol-1-yl)aniline. This chemical belongs to the following product categories: (1)Amines; (2)Phenyls & Phenyl-Het. Besides this, it is also called Phenylamine, 4-[1,2,4]triazol-1-yl-. And the chemical formula of this chemical is C₈H₈N₄.

Physical properties of 1-(4'-Aminophenyl)-1,2,4-triazole: (1)ACD/LogP: 0.04; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 33.95 Å²; (7)Index of Refraction: 1.689; (8)Molar Refractivity: 46.29 cm³; (9)Molar Volume: 121.2 cm³; (10)Polarizability: 18.35×10^-24cm³; (11)Surface Tension: 57.8 dyne/cm; (12)Density: 1.32 g/cm³; (13)Flash Point: 180.8 °C; (14)Enthalpy of Vaporization: 62.28 kJ/mol; (15)Boiling Point: 375.3 °C at 760 mmHg; (16)Vapour Pressure: 7.87E-06 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The 1-(4'-Aminophenyl)-1,2,4-triazole irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: n1cn(nc1)c2ccc(N)cc2
(2)InChI: InChI=1/C8H8N4/c9-7-1-3-8(4-2-7)12-6-10-5-11-12/h1-6H,9H2
(3)InChIKey: BLNPEJXSNSBBNM-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C8H8N4/c9-7-1-3-8(4-2-7)12-6-10-5-11-12/h1-6H,9H2
(5)Std. InChIKey: BLNPEJXSNSBBNM-UHFFFAOYSA-N