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16347-60-7

Basic Information
CAS No.: 16347-60-7
Name: 3-PHENYL-4-[3H]QUINAZOLINONE
Article Data: 80
Molecular Structure:
Molecular Structure of 16347-60-7 (3-PHENYL-4-[3H]QUINAZOLINONE)
Formula: C14H10N2O
Molecular Weight: 222.246
Synonyms: 3-Phenyl-4(3H)-quinazolinone;3-Phenyl-4-quinazolinone;3-Phenyl-4-quinazolone;3-phenyl-4-(3H)quinazolinone;
Density: 1.19 g/cm3
Melting Point: 138-140°C
Boiling Point: 391.1 °C at 760 mmHg
Flash Point: 190.3 °C
Risk Codes: 36/37/38
Safety: 26-36/37/39
PSA: 34.89000
LogP: 2.38570
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Specification

The 4(3H)-Quinazolinone, 3-phenyl- is an organic compound with the formula C14H10N2O. The IUPAC name of this chemical is 3-Phenylquinazolin-4-one. With the CAS registry number 16347-60-7, it is also named as 3-Phenyl-3-hydroquinazolin-4-one. The product's category is Quinazolinone. Besides, it should be stored in a sealed, dry, well-ventilated, lightproof place.

Physical properties about 4(3H)-Quinazolinone, 3-phenyl- are: (1)ACD/LogP: 2.34; (2)#H bond acceptors: 3; (3)#Freely Rotating Bonds: 1; (4)Polar Surface Area: 32.67 Å2; (5)Index of Refraction: 1.646; (6)Molar Refractivity: 67.27 cm3; (7)Molar Volume: 185.2 cm3; (8)Polarizability: 26.67×10-24 cm3; (9)Surface Tension: 48.9 dyne/cm; (10)Density: 1.19 g/cm3; (11)Flash Point: 190.3 °C; (12)Enthalpy of Vaporization: 64.06 kJ/mol; (13)Boiling Point: 391.1 °C at 760 mmHg; (14)Vapour Pressure: 2.53E-06 mmHg at 25 °C.

Preparation: this chemical can be prepared by 2-Amino-benzoic acid. This reaction will need reagent N,N-Dimethylacetamide. The reaction time is 6 min. The yield is about 83%.

Uses of 4(3H)-Quinazolinone, 3-phenyl-: it can be used to produce 3-Phenyl-1,2,3,4-tetrahydro-quinazoline. It will need reagent LiAlH4 and solvent diethyl ether with reaction time of 48 hours. The yield is about 67%.

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

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C14H10N2O/c17-14-12-8-4-5-9-13(12)15-10-16(14)11-6-2-1-3-7-11/h1-10H
(2)InChIKey: WAIHFZPSLVDBRV-UHFFFAOYAH
(3)Std. InChI: InChI=1S/C14H10N2O/c17-14-12-8-4-5-9-13(12)15-10-16(14)11-6-2-1-3-7-11/h1-10H
(4)Std. InChIKey: WAIHFZPSLVDBRV-UHFFFAOYSA-N