Home Halogens ethyl 4-chloro-[1,2,4]triazolo[4,3-a]quinoxaline-1-carboxylate

ethyl 4-chloro-[1,2,4]triazolo[4,3-a]quinoxaline-1-carboxylate

CAS No.:
1251017-01-2
Catalog Number:
AG01DIMB
Molecular Formula:
C12H9ClN4O2
Molecular Weight:
276.6785
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Product Description
Catalog Number:
AG01DIMB
Chemical Name:
ethyl 4-chloro-[1,2,4]triazolo[4,3-a]quinoxaline-1-carboxylate
CAS Number:
1251017-01-2
Molecular Formula:
C12H9ClN4O2
Molecular Weight:
276.6785
MDL Number:
MFCD16170471
IUPAC Name:
ethyl 4-chloro-[1,2,4]triazolo[4,3-a]quinoxaline-1-carboxylate
InChI:
InChI=1S/C12H9ClN4O2/c1-2-19-12(18)11-16-15-10-9(13)14-7-5-3-4-6-8(7)17(10)11/h3-6H,2H2,1H3
InChI Key:
METOLEXRCFYQHV-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1nnc2n1c1ccccc1nc2Cl
Properties
Complexity:
357  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.041g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.68g/mol
Monoisotopic Mass:
276.041g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
69.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties