4-Chloro-6,7-dimethoxy-2-methyl quinazoline supplier

Name
4-chloro-6,7-dimethoxy-2-methylquinazoline
EINECS 604-604-1
CAS No. 50377-49-6
Article Data10
CAS DataBase
Density 1.282 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₁ClN₂O₂
Boiling Point 286.837 °C at 760 mmHg
Molecular Weight 238.674
Flash Point 127.274 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Quinazoline, 4-chloro-6,7-dimethoxy-2-methyl-;
PSA 44.24000
LogP 2.60880

4-Chloro-6,7-dimethoxy-2-methyl quinazoline Specification

The IUPAC name of this chemical is 4-Chloro-6,7-dimethoxy-2-methyl quinazoline. With the CAS registry number 50377-49-6, it is also named as Quinazoline, 4-chloro-6,7-dimethoxy-2-methyl-. In addition, its molecular formula is C₁₁H₁₁ClN₂O₂ and molecular weight is 238.673.

Physical properties about the 4-Chloro-6,7-dimethoxy-2-methyl quinazoline are: (1)ACD/LogP: 1.98; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 9; (6)ACD/BCF (pH 7.4): 9; (7)ACD/KOC (pH 5.5): 173; (8)ACD/KOC (pH 7.4): 173; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 44.24 Å²; (13)Index of Refraction: 1.596; (14)Molar Refractivity: 63.355 cm³; (15)Molar Volume: 186.227 cm³; (16)Surface Tension: 46.482 dyne/cm; (17)Density: 1.282 g/cm³; (18)Flash Point: 127.274 °C; (19)Enthalpy of Vaporization: 50.487 kJ/mol; (20)Boiling Point: 286.837 °C at 760 mmHg; (21)Vapour Pressure: 0.004 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc2nc(nc1c2cc(OC)c(OC)c1)C
(2) InChI: InChI=1/C11H11ClN2O2/c1-6-13-8-5-10(16-3)9(15-2)4-7(8)11(12)14-6/h4-5H,1-3H3
(3) InChIKey: VHTOWTBCVHATEY-UHFFFAOYAJ

Product Name

4-chloro-6,7-dimethoxy-2-methylquinazoline

4-Chloro-6,7-dimethoxy-2-methyl quinazoline Specification

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