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89334-33-8 | 5-Quinoxalinecarboxaldehyde, 8-acetyl-
CAS No: 89334-33-8 Catalog No: AG003ZEW MDL No:
Product Description
Catalog Number:
AG003ZEW
Chemical Name:
5-Quinoxalinecarboxaldehyde, 8-acetyl-
CAS Number:
89334-33-8
Molecular Formula:
C11H8N2O2
Molecular Weight:
200.1934
IUPAC Name:
8-acetylquinoxaline-5-carbaldehyde
InChI:
InChI=1S/C11H8N2O2/c1-7(15)9-3-2-8(6-14)10-11(9)13-5-4-12-10/h2-6H,1H3
InChI Key:
VLNUZGDHGRKNHG-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c2c1nccn2)C(=O)C
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.059g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.197g/mol
Monoisotopic Mass:
200.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
59.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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