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2-Pyridinamine,5-bromo-3-(phenylmethoxy)- (754230-78-9)

Identification
Name:2-Pyridinamine,5-bromo-3-(phenylmethoxy)-
Synonyms:(3-Benzyloxy-5-bromopyridin-2-yl)amine;
CAS:754230-78-9
Molecular Formula: C12H11BrN2O
Molecular Weight: 279.13
InChI: InChI=1/C12H11BrN2O/c13-10-6-11(12(14)15-7-10)16-8-9-4-2-1-3-5-9/h1-7H,8H2,(H2,14,15)
Molecular Structure: (C12H11BrN2O) (3-Benzyloxy-5-bromopyridin-2-yl)amine;
Properties
Density:1.502
Refractive index:1.645
Specification:

The 2-Amino-5-bromo-3-benzyloxypyridine, its cas register number is 754230-78-9. It also can be called as 3-Benzyloxy-5-bromo-2-pyridinamine and the Systematic name about this chemical is 3-(benzyloxy)-5-bromopyridin-2-amine.

Physical properties about 2-Amino-5-bromo-3-benzyloxypyridine are: (1)ACD/LogP: 4.35; (2)ACD/LogD (pH 5.5): 4.35; (3)ACD/LogD (pH 7.4): 4.35; (4)ACD/BCF (pH 5.5): 1178.56; (5)ACD/BCF (pH 7.4): 1189.48; (6)ACD/KOC (pH 5.5): 5481.73; (7)ACD/KOC (pH 7.4): 5532.56; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 48.14Å2; (12)Index of Refraction: 1.645; (13)Molar Refractivity: 67.43 cm3; (14)Molar Volume: 185.8 cm3; (15)Polarizability: 26.73x10-24cm3; (16)Surface Tension: 55.2 dyne/cm; (17)Enthalpy of Vaporization: 62.44 kJ/mol; (18)Vapour Pressure: 7.11E-06 mmHg at 25°C

You can still convert the following datas into molecular structure:
(1)SMILES: Nc2ncc(Br)cc2OCc1ccccc1
(2)InChI: InChI=1/C12H11BrN2O/c13-10-6-11(12(14)15-7-10)16-8-9-4-2-1-3-5-9/h1-7H,8H2,(H2,14,15)
(3)InChIKey: ZFNMAJBVWOHSSF-UHFFFAOYAD
(4)Std. InChI: InChI=1S/C12H11BrN2O/c13-10-6-11(12(14)15-7-10)16-8-9-4-2-1-3-5-9/h1-7H,8H2,(H2,14,15)
(5)Std. InChIKey: ZFNMAJBVWOHSSF-UHFFFAOYSA-N

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