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20254-76-6 | 2-Quinoxalinecarboxylic acid, 3-chloro-
CAS No: 20254-76-6 Catalog No: AG0028B6 MDL No:MFCD09864191
Product Description
Catalog Number:
AG0028B6
Chemical Name:
2-Quinoxalinecarboxylic acid, 3-chloro-
CAS Number:
20254-76-6
Molecular Formula:
C9H5ClN2O2
Molecular Weight:
208.6012
MDL Number:
MFCD09864191
IUPAC Name:
3-chloroquinoxaline-2-carboxylic acid
InChI:
InChI=1S/C9H5ClN2O2/c10-8-7(9(13)14)11-5-3-1-2-4-6(5)12-8/h1-4H,(H,13,14)
InChI Key:
LLFXNFDLKGPZML-UHFFFAOYSA-N
SMILES:
OC(=O)c1nc2ccccc2nc1Cl
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.004g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.601g/mol
Monoisotopic Mass:
208.004g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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