2-Chloro-7-fluoroquinazolin-4(3H)-one supplier

Name
2-chloro-7-fluoroquinazolin- 4(3H)-one
EINECS
CAS No. 1107694-77-8
Density 1.612 g/cm³
Solubility
Melting Point
Formula C₈H₄ClFN₂O
Boiling Point 316.5±44.0 °C(Predicted)
Molecular Weight 198.584
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-chloro-7-fluoroquinazolin-4(3H)-one;2-chloro-7-fluoro-3H-quinazolin-4-one;
PSA 45.75000
LogP 1.71560

2-Chloro-7-fluoroquinazolin-4(3H)-one Specification

This chemical is called 4(3H)-Quinazolinone, 2-chloro-7-fluoro-, and its systematic name is 2-chloro-7-fluoro-3H-quinazolin-4-one. With the molecular formula of C₈H₄ClFN₂O, its molecular weight is 198.58 . The CAS registry number of this chemical is 1107694-77-8.

Other characteristics of the 4(3H)-Quinazolinone, 2-chloro-7-fluoro- can be summarised as followings: (1)ACD/LogP: 1.99; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.988; (4)ACD/LogD (pH 7.4): 1.856; (5)ACD/BCF (pH 5.5): 19.074; (6)ACD/BCF (pH 7.4): 14.085; (7)ACD/KOC (pH 5.5): 286.813; (8)ACD/KOC (pH 7.4): 211.794; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 41.46 Å²; (13)Index of Refraction: 1.665; (14)Molar Refractivity: 45.743 cm³; (15)Molar Volume: 123.216 cm³; (16)Polarizability: 18.134×10^-24cm³; (17)Surface Tension: 50.119 dyne/cm; (18)Density: 1.612 g/cm³.

You can still convert the following datas into molecular structure:
1.SMILES: c1cc2c(cc1F)nc([nH]c2=O)Cl
2.InChI: InChI=1/C8H4ClFN2O/c9-8-11-6-3-4(10)1-2-5(6)7(13)12-8/h1-3H,(H,11,12,13)
3.InChIKey: YRUBIFAMCRFPPC-UHFFFAOYAE

Product Name

2-chloro-7-fluoroquinazolin- 4(3H)-one

2-Chloro-7-fluoroquinazolin-4(3H)-one Specification

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