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Pyrazine, 2-(bromomethyl)-

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Name

Pyrazine, 2-(bromomethyl)-

EINECS N/A
CAS No. 60023-35-0 Density 1.642 g/cm3
PSA 25.78000 LogP 1.37150
Solubility N/A Melting Point N/A
Formula C5H5BrN2 Boiling Point 216.916 °C at 760 mmHg
Molecular Weight 173.01 Flash Point 84.988 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 60023-35-0 (Pyrazine, (bromomethyl)- (9CI)) Hazard Symbols N/A
Synonyms

Pyrazine,(bromomethyl)- (9CI);2-(Bromomethyl)pyrazine;

Article Data 5

Pyrazine, 2-(bromomethyl)- Specification

This chemical is called Pyrazine, 2-(bromomethyl)-, and its systematic name is 2-(bromomethyl)pyrazine. With the molecular formula of C5H5BrN2, its molecular weight is 173.01. The CAS registry number of this chemical is 60023-35-0. Additionally, its product category is Pyrazines.

Other characteristics of the Pyrazine, 2-(bromomethyl)- can be summarised as followings: (1)ACD/LogP: 0.70; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 40; (8)ACD/KOC (pH 7.4): 40; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 25.78 Å2; (13)Index of Refraction: 1.58; (14)Molar Refractivity: 35.084 cm3; (15)Molar Volume: 105.373 cm3; (16)Polarizability: 13.908×10-24cm3; (17)Surface Tension: 53.153 dyne/cm; (18)Density: 1.642 g/cm3; (19)Flash Point: 84.988 °C; (20)Enthalpy of Vaporization: 43.482 kJ/mol; (21)Boiling Point: 216.916 °C at 760 mmHg; (22)Vapour Pressure: 0.201 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: BrCc1cnccn1
2.InChI: InChI=1/C5H5BrN2/c6-3-5-4-7-1-2-8-5/h1-2,4H,3H2
3.InChIKey: VNMORBLLLTZLLT-UHFFFAOYAN

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