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173140-90-4 | 2(1H)-Quinolinone, 5-(2R)-2-oxiranyl-8-(phenylmethoxy)-
CAS No: 173140-90-4 Catalog No: AG001YO0 MDL No:MFCD17018704
Product Description
Catalog Number:
AG001YO0
Chemical Name:
2(1H)-Quinolinone, 5-(2R)-2-oxiranyl-8-(phenylmethoxy)-
CAS Number:
173140-90-4
Molecular Formula:
C18H15NO3
Molecular Weight:
293.3166
MDL Number:
MFCD17018704
IUPAC Name:
5-[(2R)-oxiran-2-yl]-8-phenylmethoxy-1H-quinolin-2-one
InChI:
InChI=1S/C18H15NO3/c20-17-9-7-14-13(16-11-22-16)6-8-15(18(14)19-17)21-10-12-4-2-1-3-5-12/h1-9,16H,10-11H2,(H,19,20)/t16-/m0/s1
InChI Key:
IHJYYLJZVBVLEK-INIZCTEOSA-N
SMILES:
O=c1ccc2c([nH]1)c(OCc1ccccc1)ccc2[C@@H]1CO1
EC Number:
478-690-1
Properties
Complexity:
444
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
293.105g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
293.322g/mol
Monoisotopic Mass:
293.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
50.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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