4(3H)-Quinazolinone,5-fluoro- supplier

Name
5-FLUORO-4-HYDROXYQUINAZOLINE
EINECS
CAS No. 436-72-6
Article Data8
CAS DataBase
Density 1.44 g/cm³
Solubility
Melting Point 238 °C
Formula C₈H₅FN₂O
Boiling Point 317.5 °C at 760 mmHg
Molecular Weight 164.14
Flash Point 145.8 °C
Transport Information
Appearance
Safety 26-36/37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 4(1H)-Quinazolinone,5-fluoro- (9CI);5-Fluoro-3,4-dihydro-3H-quinazolin-4-one;5-Fluoro-3,4-dihydroquinazolin-4-one;5-Fluoro-3H-quinazolin-4-one;5-Fluoroquinazolin-4(3H)-one;
PSA 46.01000
LogP 1.47450

4(3H)-Quinazolinone,5-fluoro- Specification

The 4(3H)-Quinazolinone,5-fluoro-, with the CAS registry number 436-72-6, is also known as 5-Fluoro-4-hydroxyquinazoline. It belongs to the product categories of Blocks; Heterocycles; Quinolines; Quinoline & Isoquinoline. This chemical's molecular formula is C₈H₅FN₂O and molecular weight is 164.14. Its IUPAC name is called 5-fluoro-1H-quinazolin-4-one.

Physical properties of 4(3H)-Quinazolinone,5-fluoro-: (1)ACD/LogP: 0.82; (2)ACD/LogD (pH 5.5): 0.82; (3)ACD/LogD (pH 7.4): 0.82; (4)ACD/BCF (pH 5.5): 2.48; (5)ACD/BCF (pH 7.4): 2.48; (6)ACD/KOC (pH 5.5): 66.68; (7)ACD/KOC (pH 7.4): 66.68; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)Index of Refraction: 1.642; (11)Molar Refractivity: 41.14 cm³; (12)Molar Volume: 113.8 cm³; (13)Surface Tension: 47.5 dyne/cm; (14)Density: 1.44 g/cm³; (15)Flash Point: 145.8 °C; (16)Enthalpy of Vaporization: 55.89 kJ/mol; (17)Boiling Point: 317.5 °C at 760 mmHg; (18)Vapour Pressure: 0.000384 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC2=C(C(=C1)F)C(=O)N=CN2
(2)InChI: InChI=1S/C8H5FN2O/c9-5-2-1-3-6-7(5)8(12)11-4-10-6/h1-4H,(H,10,11,12)
(3)InChIKey: UXEZULVIMJVIFB-UHFFFAOYSA-N

Product Name

5-FLUORO-4-HYDROXYQUINAZOLINE

4(3H)-Quinazolinone,5-fluoro- Specification

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