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54401-65-9 | 4H-Quinolizine-1-carbonitrile, 4-oxo-
CAS No: 54401-65-9 Catalog No: AG00I9Q3 MDL No:
Product Description
Catalog Number:
AG00I9Q3
Chemical Name:
4H-Quinolizine-1-carbonitrile, 4-oxo-
CAS Number:
54401-65-9
IUPAC Name:
4-oxoquinolizine-1-carbonitrile
InChI:
InChI=1S/C10H6N2O/c11-7-8-4-5-10(13)12-6-2-1-3-9(8)12/h1-6H
InChI Key:
ODZRQKJKMQMMNY-UHFFFAOYSA-N
Properties
Complexity:
429
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.048g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.171g/mol
Monoisotopic Mass:
170.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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