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2-Aminomethyl-3-chloropyrazine

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Name

2-Aminomethyl-3-chloropyrazine

EINECS N/A
CAS No. 771581-15-8 Density 1.331 g/cm3
PSA 51.80000 LogP 1.28900
Solubility N/A Melting Point N/A
Formula C5H6ClN3 Boiling Point 233.8 °C at 760 mmHg
Molecular Weight 143.576 Flash Point 95.2 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 771581-15-8 (2-Aminomethyl-3-chloropyrazine) Hazard Symbols N/A
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-

Article Data 14

2-Aminomethyl-3-chloropyrazine 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

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