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951884-30-3

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Basic Information
CAS No.: 951884-30-3
Name: 5-Bromo-4-sec-butylpyrimidine
Molecular Structure:
Molecular Structure of 951884-30-3 (5-Bromo-4-sec-butylpyrimidine)
Formula: C8H11BrN2
Molecular Weight: 215.0903
Synonyms: 5-bromanyl-4-butan-2-yl-pyrimidine;5-Bromo-4-sec-butylpyrimidine;
Density: 1.355 g/cm3
Boiling Point: 257.7 °C at 760 mmHg
Flash Point: 109.7 °C
PSA: 25.78000
LogP: 2.75260
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Specification

The Pyrimidine,5-bromo-4-(1-methylpropyl)-, with the CAS registry number 951884-30-3, is also known as 5-Bromo-4-(sec-butyl)pyrimidine. It belongs to the product categories of Blocks; Bromides. This chemical's molecular formula is C8H11BrN2 and molecular weight is 215.0903. Its systematic name is called 5-bromo-4-sec-butyl-pyrimidine.

Physical properties of Pyrimidine,5-bromo-4-(1-methylpropyl)-: (1)ACD/LogP: 2.53; (2)ACD/LogD (pH 5.5): 2.53; (3)ACD/LogD (pH 7.4): 2.53; (4)#H bond acceptors: 2; (5)#Freely Rotating Bonds: 2; (6)Index of Refraction: 1.529; (7)Molar Refractivity: 48.94 cm3; (8)Molar Volume: 158.6 cm3; (9)Surface Tension: 40.7 dyne/cm; (10)Density: 1.355 g/cm3; (11)Flash Point: 109.7 °C; (12)Enthalpy of Vaporization: 47.53 kJ/mol; (13)Boiling Point: 257.7 °C at 760 mmHg; (14)Vapour Pressure: 0.023 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CCC(C)c1c(cncn1)Br
(2)InChI: InChI=1/C8H11BrN2/c1-3-6(2)8-7(9)4-10-5-11-8/h4-6H,3H2,1-2H3
(3)InChIKey: QXYSMMNJSYBORC-UHFFFAOYAS