CAS No.712-76-5,4-PHENYLBENZYLAMINE Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	712-76-5
Name:	4-PHENYLBENZYLAMINE
Article Data:	3

Formula:	C₁₃H₁₃N
Molecular Weight:	183.253
Synonyms:	Benzylamine,p-phenyl- (7CI,8CI);1-(Biphenyl-4-yl)methanamine;4-(Aminomethyl)biphenyl;4-Phenylbenzylamine;Biphenyl-4-ylmethanamine;NSC 402180;[(1,1'-Biphenyl-4-yl)methyl]amine;[(Biphenyl-4-yl)methyl]amine;p-Phenylbenzylamine;
Density:	1.048±0.06 g/cm3(Predicted)
Melting Point:	48-53 °C(lit.)
Boiling Point:	325.1 °C at 760 mmHg
Flash Point:	158 °C
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36
PSA:	26.02000
LogP:	3.51260

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Specification

The 4-Phenylbenzylamine, with CAS registry number of 712-76-5, belongs to the following product categories: (1)Anilines, Aromatic Amines and Nitro Compounds; (2)Amines; (3)C11 to C38; (4)Nitrogen Compounds. It has the systematic name of 1-(biphenyl-4-yl)methanamine. And it is also named 1-(Biphenyl-4-yl)methanamine.

Physical properties about this chemical are: (1)ACD/LogP: 2.85; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 3.24 Å²; (7)Index of Refraction: 1.594; (8)Molar Refractivity: 59.29 cm³; (9)Molar Volume: 174.7 cm³; (10)Polarizability: 23.5×10^-24cm³; (11)Surface Tension: 42.6 dyne/cm; (12)Enthalpy of Vaporization: 56.72 kJ/mol; (13)Vapour Pressure: 0.000235 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The 4-Phenylbenzylamine 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: c2(c1ccc(cc1)CN)ccccc2
(2)InChI: InChI=1/C13H13N/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9H,10,14H2
(3)InChIKey: RMSPOVPGDBDYKH-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C13H13N/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9H,10,14H2
(5)Std. InChIKey: RMSPOVPGDBDYKH-UHFFFAOYSA-N