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1795-78-4 | 2(1H)-Quinoxalinone, 6-methoxy-3-phenyl-
CAS No: 1795-78-4 Catalog No: AG00271S MDL No:
Product Description
Catalog Number:
AG00271S
Chemical Name:
2(1H)-Quinoxalinone, 6-methoxy-3-phenyl-
CAS Number:
1795-78-4
Molecular Formula:
C15H12N2O2
Molecular Weight:
252.2680
IUPAC Name:
6-methoxy-3-phenyl-1H-quinoxalin-2-one
InChI:
InChI=1S/C15H12N2O2/c1-19-11-7-8-12-13(9-11)16-14(15(18)17-12)10-5-3-2-4-6-10/h2-9H,1H3,(H,17,18)
InChI Key:
ONDZFPRDTXNWGK-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)nc(c(=O)[nH]2)c1ccccc1
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.09g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
252.273g/mol
Monoisotopic Mass:
252.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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