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29071-86-1 | 2(1H)-Quinolinone, 5,6,7,8-tetrahydro-1-phenyl-
CAS No: 29071-86-1 Catalog No: AG002X9E MDL No:MFCD00680299
Product Description
Catalog Number:
AG002X9E
Chemical Name:
2(1H)-Quinolinone, 5,6,7,8-tetrahydro-1-phenyl-
CAS Number:
29071-86-1
Molecular Formula:
C15H15NO
Molecular Weight:
225.2857
MDL Number:
MFCD00680299
IUPAC Name:
1-phenyl-5,6,7,8-tetrahydroquinolin-2-one
InChI:
InChI=1S/C15H15NO/c17-15-11-10-12-6-4-5-9-14(12)16(15)13-7-2-1-3-8-13/h1-3,7-8,10-11H,4-6,9H2
InChI Key:
GGMJBVQWXWVGMJ-UHFFFAOYSA-N
SMILES:
O=c1ccc2c(n1c1ccccc1)CCCC2
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.115g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.291g/mol
Monoisotopic Mass:
225.115g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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