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| CAS No.: | 22536-62-5 |
|---|---|
| Name: | 2-CHLORO-5-PHENYL-PYRIMIDINE |
| Article Data: | 13 |
| Cas Database | |
| Molecular Structure: | |
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| Formula: | C10H7ClN2 |
| Molecular Weight: | 190.632 |
| Synonyms: | 2-Chloro-5-phenylpyrimidine; |
| EINECS: | 200-589-5 |
| Density: | 1.245g/cm3 |
| Melting Point: | 131-133 °C |
| Boiling Point: | 369.9 °C at 760 mmHg |
| Flash Point: | 209.1 °C |
| PSA: | 25.78000 |
| LogP: | 2.79700 |
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- 73441-42-6METHYL-5-CHLORO-2,2-DIMETHYLVALERATE
- 240444-70-62,3,5,6-Tetrafluor-4-(methoxymethyl)benzyl-2,2-dimethyl-3-(prop-1-en-1-yl)cyclopropancarboxylat
- 68439-39-4Poly(oxy-1,2-ethanediyl), alpha-(2-ethylhexyl)-omega-hydroxy-,
- Total:32 Page 1 of 1 1
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Specification
The Pyrimidine,2-chloro-5-phenyl-, with CAS registry number 22536-62-5, belongs to the following product category: Pharmacetical. It has the systematic name of 2-chloro-5-phenylpyrimidine. Besides this, it is also called 2-Chloro-5-phenyl-pyridimine. And the chemical formula of this chemical is C10H7ClN2.
Physical properties of Pyrimidine,2-chloro-5-phenyl-: (1)ACD/LogP: 2.12; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.12; (4)ACD/LogD (pH 7.4): 2.12; (5)ACD/BCF (pH 5.5): 23.95; (6)ACD/BCF (pH 7.4): 23.95; (7)ACD/KOC (pH 5.5): 337.96; (8)ACD/KOC (pH 7.4): 337.96; (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: 1.593; (14)Molar Refractivity: 51.92 cm3; (15)Molar Volume: 153.1 cm3; (16)Polarizability: 20.58×10-24cm3; (17)Surface Tension: 48.8 dyne/cm; (18)Density: 1.245 g/cm3; (19)Flash Point: 209.1 °C; (20)Enthalpy of Vaporization: 59.25 kJ/mol; (21)Boiling Point: 369.9 °C at 760 mmHg; (22)Vapour Pressure: 2.45E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc2ncc(c1ccccc1)cn2
(2)InChI: InChI=1/C10H7ClN2/c11-10-12-6-9(7-13-10)8-4-2-1-3-5-8/h1-7H
(3)InChIKey: JJNIWMPNOFGQEA-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C10H7ClN2/c11-10-12-6-9(7-13-10)8-4-2-1-3-5-8/h1-7H
(5)Std. InChIKey: JJNIWMPNOFGQEA-UHFFFAOYSA-N