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19973-12-7 | 2(1H)-Quinolinone, 3,4,5,6,7,8-hexahydro-1-phenyl-
CAS No: 19973-12-7 Catalog No: AG002CB7 MDL No:MFCD00219341
Product Description
Catalog Number:
AG002CB7
Chemical Name:
2(1H)-Quinolinone, 3,4,5,6,7,8-hexahydro-1-phenyl-
CAS Number:
19973-12-7
Molecular Formula:
C15H17NO
Molecular Weight:
227.3016
MDL Number:
MFCD00219341
IUPAC Name:
1-phenyl-3,4,5,6,7,8-hexahydroquinolin-2-one
InChI:
InChI=1S/C15H17NO/c17-15-11-10-12-6-4-5-9-14(12)16(15)13-7-2-1-3-8-13/h1-3,7-8H,4-6,9-11H2
InChI Key:
FBZUZMYJCHGSHH-UHFFFAOYSA-N
SMILES:
O=C1CCC2=C(N1c1ccccc1)CCCC2
Properties
Complexity:
339
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.131g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.307g/mol
Monoisotopic Mass:
227.131g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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