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7471-58-1

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Basic Information
CAS No.: 7471-58-1
Name: 2(1H)-Quinazolinone (6CI,8CI,9CI)
Article Data: 1
Molecular Structure:
Molecular Structure of 7471-58-1 (2(1H)-Quinazolinone (6CI,8CI,9CI))
Formula: C8H6N2O
Molecular Weight: 146.148
Synonyms: 1H-quinazolin-2-one;2-Quinoxalone;3-(Chloromethyl)-6-(Trifluoromethyl)Pyridine;2-Quinazolinol;2-Quinazolinone;2 (1H)-Quinazolinone;
Density: 1.31 g/cm3
Melting Point: 250 °C
Boiling Point: 395 °Cat760mmHg
Flash Point: 192.7 °C
PSA: 45.75000
LogP: 0.92310
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Chemistry

Molecule structure of 2(3H)-Quinazolinone (CAS NO.7471-58-1):

IUPAC Name: 1H-Quinazolin-2-one 
Molecular Weight: 146.14604 g/mol
Molecular Formula: C8H6N2O 
Density: 1.31 g/cm3 
Boiling Point: 395 °C at 760 mmHg 
Flash Point: 192.7 °C
Index of Refraction: 1.666
Molar Refractivity: 41.27 cm3
Molar Volume: 110.8 cm3
Surface Tension: 52.7 dyne/cm 
Enthalpy of Vaporization: 67.03 kJ/mol
Vapour Pressure: 8.33E-07 mmHg at 25 °C
XLogP3-AA: 0.7
H-Bond Donor: 1
H-Bond Acceptor: 1
Tautomer Count: 4
Exact Mass: 146.048013
MonoIsotopic Mass: 146.048013
Topological Polar Surface Area: 41.5
Heavy Atom Count: 11
Canonical SMILES: C1=CC=C2C(=C1)C=NC(=O)N2
InChI: InChI=1S/C8H6N2O/c11-8-9-5-6-3-1-2-4-7(6)10-8/h1-5H,(H,9,10,11)
InChIKey: AVRPFRMDMNDIDH-UHFFFAOYSA-N
Product Categories of 2(3H)-Quinazolinone (CAS NO.7471-58-1): PYRIMIDINE

Specification

 2(3H)-Quinazolinone (CAS NO.7471-58-1) is also named as 2(1H)-quinazolinone ; Quinazolin-2(1H)-one ; Quinazolin-2-ol ; 1,3-Naphthyridine-2 (1H)-one ; 2-Quinazolinone ; 2-Quinoxalone .