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| CAS No.: | 396-02-1 |
|---|---|
| Name: | 2,4-Dichloro-7-(trifluoromethyl)quinazoline |
| Article Data: | 11 |
| Molecular Structure: | |
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| Formula: | C9H3Cl2F3N2 |
| Molecular Weight: | 267.037 |
| Synonyms: | Quinazoline, 2,4-dichloro-7-(trifluoromethyl)-; |
| Density: | 1.595 g/cm3 |
| Boiling Point: | 222.3 °C at 760 mmHg |
| Flash Point: | 88.3 °C |
| PSA: | 25.78000 |
| LogP: | 3.95540 |
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Specification
The 2,4-Dichloro-7-(trifluoromethyl)quinazoline, with the CAS registry number 396-02-1, is also known as Quinazoline, 2,4-dichloro-7-(trifluoromethyl)-. This chemical's molecular formula is C9H3Cl2F3N2 and molecular weight is 267.03473. Its IUPAC name is called 2,4-dichloro-7-(trifluoromethyl)quinazoline.
Physical properties of 2,4-Dichloro-7-(trifluoromethyl)quinazoline: (1)ACD/LogP: 3.32; (2)ACD/LogD (pH 5.5): 3.32; (3)ACD/LogD (pH 7.4): 3.32; (4)ACD/BCF (pH 5.5): 195.27; (5)ACD/BCF (pH 7.4): 195.27; (6)ACD/KOC (pH 5.5): 1517.9; (7)ACD/KOC (pH 7.4): 1517.9; (8)#H bond acceptors: 2; (9)Index of Refraction: 1.571; (10)Molar Refractivity: 55.04 cm3; (11)Molar Volume: 167.4 cm3; (12)Surface Tension: 42.8 dyne/cm; (13)Density: 1.595 g/cm3; (14)Flash Point: 88.3 °C; (15)Enthalpy of Vaporization: 44.01 kJ/mol; (16)Boiling Point: 222.3 °C at 760 mmHg; (17)Vapour Pressure: 0.152 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC2=C(C=C1C(F)(F)F)N=C(N=C2Cl)Cl
(2)InChI: InChI=1S/C9H3Cl2F3N2/c10-7-5-2-1-4(9(12,13)14)3-6(5)15-8(11)16-7/h1-3H
(3)InChIKey: PRJBXUBPUYNFQF-UHFFFAOYSA-N