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59663-81-9 | 1,2,3,5,6,7,8,9-OCTAHYDRO-4H-CYCLOPENTA[C]QUINOLIN-4-ONE
CAS No: 59663-81-9 Catalog No: AG01APM7 MDL No:MFCD22613713
Product Description
Catalog Number:
AG01APM7
Chemical Name:
1,2,3,5,6,7,8,9-OCTAHYDRO-4H-CYCLOPENTA[C]QUINOLIN-4-ONE
CAS Number:
59663-81-9
Molecular Formula:
C12H15NO
Molecular Weight:
189.2536
MDL Number:
MFCD22613713
IUPAC Name:
1,2,3,5,6,7,8,9-octahydrocyclopenta[c]quinolin-4-one
InChI:
InChI=1S/C12H15NO/c14-12-10-6-3-5-8(10)9-4-1-2-7-11(9)13-12/h1-7H2,(H,13,14)
InChI Key:
YPDWWSMFSQNAFV-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2CCCCc2c2c1CCC2
Properties
Complexity:
363
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.115g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.258g/mol
Monoisotopic Mass:
189.115g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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