CAS No.31676-54-7,5-PHENYL-PYRIDIN-3-YLAMINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	31676-54-7
Name:	5-PHENYL-PYRIDIN-3-YLAMINE
Article Data:	7

Formula:	C₁₁H₁₀N₂
Molecular Weight:	170.214
Synonyms:	Pyridine,3-amino-5-phenyl- (8CI);3-Amino-5-phenylpyridine;
Density:	1.133 g/cm³
Boiling Point:	389.4 °C at 760 mmHg
Flash Point:	217.7 °C
Risk Codes:	41
Safety:	26-39
PSA:	38.91000
LogP:	2.91200

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Specification

The CAS register number of 3-Pyridinamine,5-phenyl- is 31676-54-7. It also can be called as 3-Amino-5-phenylpyridine and the systematic name about this chemical is 5-phenylpyridin-3-amine. The molecular formula about this chemical is C₁₁H₁₀N₂ and the molecular weight is 170.21.

Physical properties about 3-Pyridinamine,5-phenyl- are: (1)ACD/LogP: 1.64; (2)ACD/LogD (pH 5.5): 1.44; (3)ACD/LogD (pH 7.4): 1.63; (4)ACD/BCF (pH 5.5): 6.52; (5)ACD/BCF (pH 7.4): 10.26; (6)ACD/KOC (pH 5.5): 116.81; (7)ACD/KOC (pH 7.4): 183.83; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 16.13Å²; (12)Index of Refraction: 1.625; (13)Molar Refractivity: 53.17 cm³; (14)Molar Volume: 150.2 cm³; (15)Polarizability: 21.07x10^-24cm³; (16)Surface Tension: 50.5 dyne/cm; (17)Flash Point: 217.7 °C; (18)Enthalpy of Vaporization: 63.87 kJ/mol; (19)Boiling Point: 389.4 °C at 760 mmHg; (20)Vapour Pressure: 2.86E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: n2cc(c1ccccc1)cc(N)c2
(2)InChI: InChI=1/C11H10N2/c12-11-6-10(7-13-8-11)9-4-2-1-3-5-9/h1-8H,12H2
(3)InChIKey: BAXUDPKGRMMFBV-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C11H10N2/c12-11-6-10(7-13-8-11)9-4-2-1-3-5-9/h1-8H,12H2
(5)Std. InChIKey: BAXUDPKGRMMFBV-UHFFFAOYSA-N