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113567-28-5 | 4(1H)-Quinolinone, 2,3-dihydro-2-phenyl-, (2S)-
CAS No: 113567-28-5 Catalog No: AG00090O MDL No:
Product Description
Catalog Number:
AG00090O
Chemical Name:
4(1H)-Quinolinone, 2,3-dihydro-2-phenyl-, (2S)-
CAS Number:
113567-28-5
Molecular Formula:
C15H13NO
Molecular Weight:
223.2698
IUPAC Name:
(2S)-2-phenyl-2,3-dihydro-1H-quinolin-4-one
InChI:
InChI=1S/C15H13NO/c17-15-10-14(11-6-2-1-3-7-11)16-13-9-5-4-8-12(13)15/h1-9,14,16H,10H2/t14-/m0/s1
InChI Key:
PUCZUBFZQVSURB-AWEZNQCLSA-N
SMILES:
O=C1C[C@H](Nc2c1cccc2)c1ccccc1
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
223.1g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
223.275g/mol
Monoisotopic Mass:
223.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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