5-Bromo-2-(cyclobutyl)pyrimidine supplier

Name
5-Bromo-2-(cyclobutyl)pyrimidine
EINECS
CAS No. 893567-22-1
Article Data3
CAS DataBase
Density 1.5±0.1 g/cm³
Solubility
Melting Point
Formula C₈H₉BrN₂
Boiling Point 272.6±13.0 °C at 760 mmHg
Molecular Weight 213.077
Flash Point 118.6±19.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Pyrimidine, 5-bromo-2-cyclobutyl-;
PSA 25.78000
LogP 2.50660

5-Bromo-2-(cyclobutyl)pyrimidine Specification

The 5-Bromo-2-(cyclobutyl)pyrimidine, with the CAS registry number 893567-22-1, is also known as Pyrimidine, 5-bromo-2-cyclobutyl-. This chemical's molecular formula is C₈H₉BrN₂ and molecular weight is 211.99. What's more, its systematic name is the same with its product name.

Physical properties about 5-Bromo-2-(cyclobutyl)pyrimidine are: (1)ACD/LogP: 1.88±0.31 ; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.88; (4)ACD/LogD (pH 7.4): 1.88; (5)ACD/BCF (pH 5.5): 15.80; (6)ACD/BCF (pH 7.4): 15.80; (7)ACD/KOC (pH 5.5): 250.94; (8)ACD/KOC (pH 7.4): 250.95; (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: 1.594; (14)Molar Refractivity: 46.8±0.3 cm³; (15)Molar Volume: 137.8±3.0 cm³; (16)Polarizability: 18.5±0.5×10^-24cm³; (17)Surface Tension: 53.3±3.0 dyne/cm; (18)Density: 1.5±0.1 g/cm³; (19)Flash Point: 118.6±19.8 °C; (20)Enthalpy of Vaporization: 49.0±3.0 kJ/mol; (21)Boiling Point: 272.6±13.0 °C at 760 mmHg; (22)Vapour Pressure: 0.0±0.5 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: c1c(cnc(n1)C2CCC2)Br
(2) InChI: InChI=1S/C8H9BrN2/c9-7-4-10-8(11-5-7)6-2-1-3-6/h4-6H,1-3H2
(3) InChIKey: GGRDQVNIRHJZCI-UHFFFAOYSA-N

Product Name

5-Bromo-2-(cyclobutyl)pyrimidine

5-Bromo-2-(cyclobutyl)pyrimidine Specification

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