4(3H)-Quinazolinone,6-methoxy-7-phenoxy- supplier

Name
4(3H)-Quinazolinone,6-methoxy-7-phenoxy-
EINECS
CAS No. 1086385-94-5
Density 1.294 g/cm³
Solubility
Melting Point
Formula C₁₅H₁₂N₂O₃
Boiling Point 504.878 °C at 760 mmHg
Molecular Weight 268.2674
Flash Point 259.141 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 6-Methoxy-7-phenoxyquinazolin-4(3H)-one;
PSA
LogP

4(3H)-Quinazolinone,6-methoxy-7-phenoxy- Specification

The 4(3H)-Quinazolinone,6-methoxy-7-phenoxy-, with the CAS registry number 1086385-94-5, is also known as 6-Methoxy-7-phenoxy-4(3H)-quinazolinone. This chemical's molecular formula is C₁₅H₁₂N₂O₃ and molecular weight is 268.2674. What's more, its systematic name is called 6-Methoxy-7-phenoxyquinazolin-4(3H)-one.

Physical properties about 4(3H)-Quinazolinone,6-methoxy-7-phenoxy- are: (1)ACD/LogP: 2.08; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.079; (4)ACD/LogD (pH 7.4): 2.079; (5)ACD/BCF (pH 5.5): 22.393; (6)ACD/BCF (pH 7.4): 22.373; (7)ACD/KOC (pH 5.5): 322.13; (8)ACD/KOC (pH 7.4): 321.84; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 59.92 Å²; (13)Index of Refraction: 1.628 ; (14)Molar Refractivity: 73.58 cm³; (15)Molar Volume: 207.386 cm³; (16)Surface Tension: 47.736 dyne/cm; (17)Density: 1.294 g/cm³; (18)Flash Point: 259.141 °C; (19)Enthalpy of Vaporization: 77.443 kJ/mol; (20)Boiling Point: 504.878 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: COc1cc2c(cc1Oc3ccccc3)nc[nH]c2=O
(2) InChI: InChI=1/C15H12N2O3/c1-19-13-7-11-12(16-9-17-15(11)18)8-14(13)20-10-5-3-2-4-6-10/h2-9H,1H3,(H,16,17,18)
(3) InChIKey: ADRULWJRCOPVEL-UHFFFAOYAR

Product Name

4(3H)-Quinazolinone,6-methoxy-7-phenoxy-

4(3H)-Quinazolinone,6-methoxy-7-phenoxy- Specification

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