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67570-55-2 | 2-Quinoxalinecarboxaldehyde, 3-(phenylamino)-
CAS No: 67570-55-2 Catalog No: AG006E3B MDL No:
Product Description
Catalog Number:
AG006E3B
Chemical Name:
2-Quinoxalinecarboxaldehyde, 3-(phenylamino)-
CAS Number:
67570-55-2
Molecular Formula:
C15H11N3O
Molecular Weight:
249.2673
IUPAC Name:
3-anilinoquinoxaline-2-carbaldehyde
InChI:
InChI=1S/C15H11N3O/c19-10-14-15(16-11-6-2-1-3-7-11)18-13-9-5-4-8-12(13)17-14/h1-10H,(H,16,18)
InChI Key:
LCTAALULVOMLRM-UHFFFAOYSA-N
SMILES:
O=Cc1nc2ccccc2nc1Nc1ccccc1
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.09g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
249.273g/mol
Monoisotopic Mass:
249.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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