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857209-32-6 | 2-Quinolinecarbamic acid (6CI)
CAS No: 857209-32-6 Catalog No: AG008GUP MDL No:
Product Description
Catalog Number:
AG008GUP
Chemical Name:
2-Quinolinecarbamic acid (6CI)
CAS Number:
857209-32-6
Molecular Formula:
C10H8N2O2
Molecular Weight:
188.1827
IUPAC Name:
quinolin-2-ylcarbamic acid
InChI:
InChI=1S/C10H8N2O2/c13-10(14)12-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H,(H,11,12)(H,13,14)
InChI Key:
IHDRVAVNEDBQFF-UHFFFAOYSA-N
SMILES:
OC(=O)Nc1ccc2c(n1)cccc2
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.059g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
188.186g/mol
Monoisotopic Mass:
188.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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