Name: 2-Aminomethyl-3-chloropyrazine
SKU: 771581-15-8

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Basic Information

Molecular Structure:
CAS No.:	771581-15-8
Name:	2-Aminomethyl-3-chloropyrazine
Article Data:	14

Formula:	C₅H₆ClN₃
Molecular Weight:	143.576
Synonyms:	2-AMINOMETHYL-3-CHLOROPYRAZINE;RARECHEM AL BW 0872;(3-CHLOROPYRAZIN-2-YL)METHYLAMINE;(3-Chloropyrazin-2-yl)methanamine;C-(3-Chloro-pyrazin-2-yl)-MethylaMine;2-pyrazineMethanaMine, 3-chloro-
Density:	1.331 g/cm³
Boiling Point:	233.8 °C at 760 mmHg
Flash Point:	95.2 °C
PSA:	51.80000
LogP:	1.28900

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Specification

The 2-Aminomethyl-3-chloropyrazine is an organic compound with the formula C₅H₆ClN₃. The systematic name of this chemical is 1-(3-chloropyrazin-2-yl)methanamine. With the CAS registry number 771581-15-8, it is also named as (3-Chloropyrazin-2-yl)methanamine.

Physical properties about 2-Aminomethyl-3-chloropyrazine are: (1)ACD/LogP: -0.49; (2)ACD/LogD (pH 5.5): -1.01; (3)ACD/LogD (pH 7.4): -0.5; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 3.89; (7)ACD/KOC (pH 7.4): 12.54; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 29.02 Å²; (12)Index of Refraction: 1.578; (13)Molar Refractivity: 35.78 cm³; (14)Molar Volume: 107.8 cm³; (15)Polarizability: 14.18×10^-24cm³; (16)Surface Tension: 57.7 dyne/cm; (17)Density: 1.331 g/cm³; (18)Flash Point: 95.2 °C; (19)Enthalpy of Vaporization: 47.05 kJ/mol; (20)Boiling Point: 233.8 °C at 760 mmHg; (21)Vapour Pressure: 0.0548 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1nccnc1CN
(2)InChI: InChI=1/C5H6ClN3/c6-5-4(3-7)8-1-2-9-5/h1-2H,3,7H2
(3)InChIKey: PODCTQRYFHFTPT-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C5H6ClN3/c6-5-4(3-7)8-1-2-9-5/h1-2H,3,7H2
(5)Std. InChIKey: PODCTQRYFHFTPT-UHFFFAOYSA-N