2-Cyano-5-bromomethylpyridine supplier

Name
2-Cyano-5-bromomethylpyridine
EINECS
CAS No. 308846-06-2
Article Data13
CAS DataBase
Density 1.607 g/cm³
Solubility
Melting Point
Formula C₇H₅BrN₂
Boiling Point 329.5 ºC at 760 mmHg
Molecular Weight 197.034
Flash Point 153.1 ºC
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5-(Bromomethyl)-2-pyridinecarbonitrile;5-(Bromomethyl)pyridin-2-carbonitrile;5-Bromomethyl-2-cyanopyridine;
PSA 36.68000
LogP 1.84818

2-Cyano-5-bromomethylpyridine Specification

The 2-Cyano-5-bromomethylpyridine, with its CAS registry number 308846-06-2, has the systematic name of 5-(bromomethyl)pyridine-2-carbonitrile. And its product categories are including Methyl Halides; Pyridines; Methyl Halides.

The characteristics of Styron G 9001 are as follows: (1)ACD/LogP: 1.67; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 5; (6)ACD/BCF (pH 7.4): 5; (7)ACD/KOC (pH 5.5): 109; (8)ACD/KOC (pH 7.4): 109; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 36.68; (13)Index of Refraction: 1.592; (14)Molar Refractivity: 41.471 cm³; (15)Molar Volume: 122.586 cm³; (16)Polarizability: 16.44×10^-24 cm³; (17)Surface Tension: 58.973 dyne/cm; (18)Density: 1.607 g/cm³; (19)Flash Point: 153.087 °C; (20)Enthalpy of Vaporization: 57.201 kJ/mol; (21)Boiling Point: 329.518 °C at 760 mmHg.

What's more, the following datas could be converted into the molecular structure:
(1)SMILES:N#Cc1ccc(CBr)cn1
(2)InChI:InChI=1/C7H5BrN2/c8-3-6-1-2-7(4-9)10-5-6/h1-2,5H,3H2
(3)InChIKey:VEPVNICICSNYPW-UHFFFAOYAJ

Product Name

2-Cyano-5-bromomethylpyridine

2-Cyano-5-bromomethylpyridine Specification

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