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17796-60-0 | 2(1H)-Quinoxalinone, 7-chloro-3-methyl-
CAS No: 17796-60-0 Catalog No: AG0025NW MDL No:MFCD15730001
Product Description
Catalog Number:
AG0025NW
Chemical Name:
2(1H)-Quinoxalinone, 7-chloro-3-methyl-
CAS Number:
17796-60-0
Molecular Formula:
C9H7ClN2O
Molecular Weight:
194.6177
MDL Number:
MFCD15730001
IUPAC Name:
7-chloro-3-methyl-1H-quinoxalin-2-one
InChI:
InChI=1S/C9H7ClN2O/c1-5-9(13)12-8-4-6(10)2-3-7(8)11-5/h2-4H,1H3,(H,12,13)
InChI Key:
AWJVVPSBHNSAAN-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)[nH]c(=O)c(n2)C
NSC Number:
86898
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.025g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
194.618g/mol
Monoisotopic Mass:
194.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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