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139351-45-4 | Benzoquinolinone
CAS No: 139351-45-4 Catalog No: AG001ASU MDL No:
Product Description
Catalog Number:
AG001ASU
Chemical Name:
Benzoquinolinone
CAS Number:
139351-45-4
Molecular Formula:
C13H9NO
Molecular Weight:
195.2167
IUPAC Name:
1H-benzo[h]quinolin-2-one
InChI:
InChI=1S/C13H9NO/c15-12-8-7-10-6-5-9-3-1-2-4-11(9)13(10)14-12/h1-8H,(H,14,15)
InChI Key:
UIWLITBBFICQKW-UHFFFAOYSA-N
SMILES:
O=c1ccc2c([nH]1)c1ccccc1cc2
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.068g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
195.221g/mol
Monoisotopic Mass:
195.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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