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31507-87-6 | 1,2,3,4-Tetrahydro-4-oxo-11bH-benzo[a]quinolizine-11b-carbonitrile
CAS No: 31507-87-6 Catalog No: AG00D0DE MDL No:
Product Description
Catalog Number:
AG00D0DE
Chemical Name:
1,2,3,4-Tetrahydro-4-oxo-11bH-benzo[a]quinolizine-11b-carbonitrile
CAS Number:
31507-87-6
IUPAC Name:
4-oxo-2,3-dihydro-1H-benzo[a]quinolizine-11b-carbonitrile
InChI:
InChI=1S/C14H12N2O/c15-10-14-8-3-6-13(17)16(14)9-7-11-4-1-2-5-12(11)14/h1-2,4-5,7,9H,3,6,8H2
InChI Key:
NHIUPAICDDHRBB-UHFFFAOYSA-N
NSC Number:
140897
Properties
Complexity:
419
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.095g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.263g/mol
Monoisotopic Mass:
224.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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