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82500-92-3 | 2(1H)-Quinoxalinone, 3-[(2-methoxyphenyl)methyl]-
CAS No: 82500-92-3 Catalog No: AG004Z6Y MDL No:
Product Description
Catalog Number:
AG004Z6Y
Chemical Name:
2(1H)-Quinoxalinone, 3-[(2-methoxyphenyl)methyl]-
CAS Number:
82500-92-3
Molecular Formula:
C16H14N2O2
Molecular Weight:
266.2946
IUPAC Name:
3-[(2-methoxyphenyl)methyl]-1H-quinoxalin-2-one
InChI:
InChI=1S/C16H14N2O2/c1-20-15-9-5-2-6-11(15)10-14-16(19)18-13-8-4-3-7-12(13)17-14/h2-9H,10H2,1H3,(H,18,19)
InChI Key:
FXBKTHIASNACLB-UHFFFAOYSA-N
SMILES:
COc1ccccc1Cc1nc2ccccc2[nH]c1=O
Properties
Complexity:
394
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.106g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
266.3g/mol
Monoisotopic Mass:
266.106g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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