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10173-29-2 | Quinoxaline, 2-phenyl-3-(phenylmethyl)-
CAS No: 10173-29-2 Catalog No: AG0005C2 MDL No:
Product Description
Catalog Number:
AG0005C2
Chemical Name:
Quinoxaline, 2-phenyl-3-(phenylmethyl)-
CAS Number:
10173-29-2
Molecular Formula:
C21H16N2
Molecular Weight:
296.3651
IUPAC Name:
2-benzyl-3-phenylquinoxaline
InChI:
InChI=1S/C21H16N2/c1-3-9-16(10-4-1)15-20-21(17-11-5-2-6-12-17)23-19-14-8-7-13-18(19)22-20/h1-14H,15H2
InChI Key:
UBXOGFPNPVOWAQ-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)Cc1nc2ccccc2nc1c1ccccc1
Properties
Complexity:
357
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.131g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.373g/mol
Monoisotopic Mass:
296.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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