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1256822-12-4 | 6-Quinolinecarboxylic acid, 5,6,7,8-tetrahydro-
CAS No: 1256822-12-4 Catalog No: AG000OG6 MDL No:MFCD18261171
Product Description
Catalog Number:
AG000OG6
Chemical Name:
6-Quinolinecarboxylic acid, 5,6,7,8-tetrahydro-
CAS Number:
1256822-12-4
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
MDL Number:
MFCD18261171
IUPAC Name:
5,6,7,8-tetrahydroquinoline-6-carboxylic acid
InChI:
InChI=1S/C10H11NO2/c12-10(13)8-3-4-9-7(6-8)2-1-5-11-9/h1-2,5,8H,3-4,6H2,(H,12,13)
InChI Key:
BNMHRKQDWDPFKU-UHFFFAOYSA-N
SMILES:
OC(=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:
177.079g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.203g/mol
Monoisotopic Mass:
177.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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