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Basic Information
CAS No.: 27794-00-9
Name: Pyrimidine, 5-(4-bromophenyl)-2-chloro-
Molecular Structure:
Molecular Structure of 27794-00-9 (Pyrimidine, 5-(4-bromophenyl)-2-chloro-)
Formula: C10H6BrClN2
Molecular Weight: 269.528
Synonyms: Pyrimidine, 5-(p-bromophenyl)-2-chloro- (8CI);
Density: 1.592 g/cm3
Boiling Point: 416.723 °C at 760 mmHg
Flash Point: 205.827 °C
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Specification

The Pyrimidine, 5-(4-bromophenyl)-2-chloro-, with the CAS registry number 27794-00-9, is also known as Pyrimidine, 5-(p-bromophenyl)-2-chloro- (8CI). This chemical's molecular formula is C10H6BrClN2 and molecular weight is 269.53. What's more, its systematic name is 5-(4-Bromophenyl)-2-chloro-pyrimidine

Physical properties about Pyrimidine, 5-(4-bromophenyl)-2-chloro- are: (1)ACD/LogP: 3.10; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.1; (4)ACD/LogD (pH 7.4): 3.1; (5)ACD/BCF (pH 5.5): 133.695; (6)ACD/BCF (pH 7.4): 133.695; (7)ACD/KOC (pH 5.5): 1157.399; (8)ACD/KOC (pH 7.4): 1157.399; (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: 1.622; (14)Molar Refractivity: 59.612 cm3; (15)Molar Volume: 169.301 cm3; (16)Polarizability: 23.632×10-24 cm3; (17)Surface Tension: 52.302 dyne/cm; (18)Density: 1.592 g/cm3; (19)Flash Point: 205.827 °C; (20)Enthalpy of Vaporization: 64.401 kJ/mol; (21)Boiling Point: 416.723 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: c1cc(ccc1c2cnc(nc2)Cl)Br
(2) InChI: InChI=1/C10H6BrClN2/c11-9-3-1-7(2-4-9)8-5-13-10(12)14-6-8/h1-6H
(3) InChIKey: HUZUIPCKZHNORT-UHFFFAOYAX