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758684-45-6 | 4(3H)-Quinolinone
CAS No: 758684-45-6 Catalog No: AG005I2X MDL No:
Product Description
Catalog Number:
AG005I2X
Chemical Name:
4(3H)-Quinolinone
CAS Number:
758684-45-6
Molecular Formula:
C9H7NO
Molecular Weight:
145.1580
IUPAC Name:
3H-quinolin-4-one
InChI:
InChI=1S/C9H7NO/c11-9-5-6-10-8-4-2-1-3-7(8)9/h1-4,6H,5H2
InChI Key:
HETSDWRDICBRSQ-UHFFFAOYSA-N
SMILES:
O=C1CC=Nc2c1cccc2
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.053g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
145.161g/mol
Monoisotopic Mass:
145.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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