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114935-74-9 | Ethanone, 1-(4-azido-2-quinolinyl)-
CAS No: 114935-74-9 Catalog No: AG000FGH MDL No:
Product Description
Catalog Number:
AG000FGH
Chemical Name:
Ethanone, 1-(4-azido-2-quinolinyl)-
CAS Number:
114935-74-9
Molecular Formula:
C11H8N4O
Molecular Weight:
212.2074
IUPAC Name:
1-(4-azidoquinolin-2-yl)ethanone
InChI:
InChI=1S/C11H8N4O/c1-7(16)10-6-11(14-15-12)8-4-2-3-5-9(8)13-10/h2-6H,1H3
InChI Key:
JBCGCQIGZYOFAG-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=Nc1cc(nc2c1cccc2)C(=O)C
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.07g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.212g/mol
Monoisotopic Mass:
212.07g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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