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Home > Indoles and Oxindole > 781647-83-4
781647-83-4 | 2H-Indol-2-one, 1,3-dihydro-3-hydroxy-3-phenyl-, (3R)-
CAS No: 781647-83-4 Catalog No: AG0054ST MDL No:
Product Description
Catalog Number:
AG0054ST
Chemical Name:
2H-Indol-2-one, 1,3-dihydro-3-hydroxy-3-phenyl-, (3R)-
CAS Number:
781647-83-4
Molecular Formula:
C14H11NO2
Molecular Weight:
225.2426
IUPAC Name:
(3R)-3-hydroxy-3-phenyl-1H-indol-2-one
InChI:
InChI=1S/C14H11NO2/c16-13-14(17,10-6-2-1-3-7-10)11-8-4-5-9-12(11)15-13/h1-9,17H,(H,15,16)/t14-/m1/s1
InChI Key:
CYPJCGXWLXXEHL-CQSZACIVSA-N
SMILES:
O=C1Nc2c([C@]1(O)c1ccccc1)cccc2
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
225.079g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
225.247g/mol
Monoisotopic Mass:
225.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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