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Home > Quinoline > 1567360-56-8
1567360-56-8 | 4-Quinolinecarbonitrile, 1,2,3,4-tetrahydro-7-methoxy-2-oxo-
CAS No: 1567360-56-8 Catalog No: AG001OXN MDL No:MFCD27996313
Product Description
Catalog Number:
AG001OXN
Chemical Name:
4-Quinolinecarbonitrile, 1,2,3,4-tetrahydro-7-methoxy-2-oxo-
CAS Number:
1567360-56-8
Molecular Formula:
C11H10N2O2
Molecular Weight:
202.2093
MDL Number:
MFCD27996313
IUPAC Name:
7-methoxy-2-oxo-3,4-dihydro-1H-quinoline-4-carbonitrile
InChI:
InChI=1S/C11H10N2O2/c1-15-8-2-3-9-7(6-12)4-11(14)13-10(9)5-8/h2-3,5,7H,4H2,1H3,(H,13,14)
InChI Key:
KCZDGDWURFYGIW-UHFFFAOYSA-N
SMILES:
N#CC1CC(=O)Nc2c1ccc(c2)OC
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.074g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.213g/mol
Monoisotopic Mass:
202.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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