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53400-41-2 | 5,6,7,8-TETRAHYDROQUINOLINONE-5
CAS No: 53400-41-2 Catalog No: AG00D8FG MDL No:MFCD02181161
Product Description
Catalog Number:
AG00D8FG
Chemical Name:
5,6,7,8-TETRAHYDROQUINOLINONE-5
CAS Number:
53400-41-2
Molecular Formula:
C9H9NO
Molecular Weight:
147.1739
MDL Number:
MFCD02181161
IUPAC Name:
7,8-dihydro-6H-quinolin-5-one
InChI:
InChI=1S/C9H9NO/c11-9-5-1-4-8-7(9)3-2-6-10-8/h2-3,6H,1,4-5H2
InChI Key:
YHHBKPWMEXGLKE-UHFFFAOYSA-N
SMILES:
O=C1CCCc2c1cccn2
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.068g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
147.177g/mol
Monoisotopic Mass:
147.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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