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169040-40-8 | 2H-Indol-2-one, 5-chloro-1,3-dihydro-3-hydroxy-3-(2-methoxyphenyl)-
CAS No: 169040-40-8 Catalog No: AG001YGA MDL No:
Product Description
Catalog Number:
AG001YGA
Chemical Name:
2H-Indol-2-one, 5-chloro-1,3-dihydro-3-hydroxy-3-(2-methoxyphenyl)-
CAS Number:
169040-40-8
Molecular Formula:
C15H12ClNO3
Molecular Weight:
289.7137
IUPAC Name:
5-chloro-3-hydroxy-3-(2-methoxyphenyl)-1H-indol-2-one
InChI:
InChI=1S/C15H12ClNO3/c1-20-13-5-3-2-4-10(13)15(19)11-8-9(16)6-7-12(11)17-14(15)18/h2-8,19H,1H3,(H,17,18)
InChI Key:
MQWUODCBPPWSIJ-UHFFFAOYSA-N
SMILES:
COc1ccccc1C1(O)C(=O)Nc2c1cc(Cl)cc2
Properties
Complexity:
391
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.051g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
289.715g/mol
Monoisotopic Mass:
289.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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