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123342-17-6 | 2(1H)-Quinoxalinone, 7-chloro-6-methoxy-
CAS No: 123342-17-6 Catalog No: AG000KFC MDL No:
Product Description
Catalog Number:
AG000KFC
Chemical Name:
2(1H)-Quinoxalinone, 7-chloro-6-methoxy-
CAS Number:
123342-17-6
Molecular Formula:
C9H7ClN2O2
Molecular Weight:
210.6171
IUPAC Name:
7-chloro-6-methoxy-1H-quinoxalin-2-one
InChI:
InChI=1S/C9H7ClN2O2/c1-14-8-3-6-7(2-5(8)10)12-9(13)4-11-6/h2-4H,1H3,(H,12,13)
InChI Key:
NBUVRDBKTVPTTA-UHFFFAOYSA-N
SMILES:
COc1cc2ncc(=O)[nH]c2cc1Cl
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.02g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
210.617g/mol
Monoisotopic Mass:
210.02g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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