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473932-16-0 | 6-Quinoxalineacetic acid
CAS No: 473932-16-0 Catalog No: AG0039PO MDL No:MFCD09880609
Product Description
Catalog Number:
AG0039PO
Chemical Name:
6-Quinoxalineacetic acid
CAS Number:
473932-16-0
Molecular Formula:
C10H8N2O2
Molecular Weight:
188.1827
MDL Number:
MFCD09880609
IUPAC Name:
2-quinoxalin-6-ylacetic acid
InChI:
InChI=1S/C10H8N2O2/c13-10(14)6-7-1-2-8-9(5-7)12-4-3-11-8/h1-5H,6H2,(H,13,14)
InChI Key:
NRRFVLPMUSJDJY-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1ccc2c(c1)nccn2
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:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
188.186g/mol
Monoisotopic Mass:
188.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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