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286371-65-1

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Basic Information
CAS No.: 286371-65-1
Name: 4-Chloro-7-methoxy-6-benzyloxyquinazoline
Article Data: 12
Molecular Structure:
Molecular Structure of 286371-65-1 (4-Chloro-7-methoxy-6-benzyloxyquinazoline)
Formula: C16H13ClN2O2
Molecular Weight: 300.744
Synonyms: 6-(Benzyloxy)-4-chloro-7-methoxyquinazoline;
Density: 1.303 g/cm3
Boiling Point: 452.06 °C at 760 mmHg
Flash Point: 227.198 °C
PSA: 44.24000
LogP: 3.87080
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Specification

This chemical is called 4-Chloro-7-methoxy-6-benzyloxyquinazoline, and its systematic name is 6-(benzyloxy)-4-chloro-7-methoxyquinazoline. With the molecular formula of C16H13ClN2O2, its molecular weight is 300.74. The CAS registry number of this chemical is 286371-65-1.

Other characteristics of the 4-Chloro-7-methoxy-6-benzyloxyquinazoline can be summarised as followings: (1)ACD/LogP: 2.37; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 128; (6)ACD/BCF (pH 7.4): 128; (7)ACD/KOC (pH 5.5): 1121; (8)ACD/KOC (pH 7.4): 1121; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 44.24 Å2; (13)Index of Refraction: 1.639; (14)Molar Refractivity: 83.017 cm3; (15)Molar Volume: 230.654 cm3; (16)Polarizability: 32.911×10-24cm3; (17)Surface Tension: 52.462 dyne/cm; (18)Density: 1.304 g/cm3; (19)Flash Point: 227.198 °C; (20)Enthalpy of Vaporization: 68.389 kJ/mol; (21)Boiling Point: 452.06 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: Clc3ncnc2c3cc(OCc1ccccc1)c(OC)c2
2.InChI: InChI=1/C16H13ClN2O2/c1-20-14-8-13-12(16(17)19-10-18-13)7-15(14)21-9-11-5-3-2-4-6-11/h2-8,10H,9H2,1H3
3.InChIKey: RQNQROBHHNEDMF-UHFFFAOYAY