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5382-43-4 | quinoline-6-carboxaMide
CAS No: 5382-43-4 Catalog No: AG00DKUV MDL No:MFCD01312760
Product Description
Catalog Number:
AG00DKUV
Chemical Name:
quinoline-6-carboxaMide
CAS Number:
5382-43-4
Molecular Formula:
C10H8N2O
Molecular Weight:
172.1833
MDL Number:
MFCD01312760
IUPAC Name:
quinoline-6-carboxamide
InChI:
InChI=1S/C10H8N2O/c11-10(13)8-3-4-9-7(6-8)2-1-5-12-9/h1-6H,(H2,11,13)
InChI Key:
YMNAJWHTELQUJU-UHFFFAOYSA-N
SMILES:
NC(=O)c1ccc2c(c1)cccn2
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.064g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
172.187g/mol
Monoisotopic Mass:
172.064g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
56A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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