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Home > Indoles and Oxindole > 1349718-04-2
1349718-04-2 | 3-(2-Oxoindolin-5-yl)benzyl alcohol
CAS No: 1349718-04-2 Catalog No: AG01FDVU MDL No:
Product Description
Catalog Number:
AG01FDVU
Chemical Name:
3-(2-Oxoindolin-5-yl)benzyl alcohol
CAS Number:
1349718-04-2
Molecular Formula:
C15H13NO2
Molecular Weight:
239.2692
IUPAC Name:
5-[3-(hydroxymethyl)phenyl]-1,3-dihydroindol-2-one
InChI:
InChI=1S/C15H13NO2/c17-9-10-2-1-3-11(6-10)12-4-5-14-13(7-12)8-15(18)16-14/h1-7,17H,8-9H2,(H,16,18)
InChI Key:
NSUWETXKQITDIG-UHFFFAOYSA-N
SMILES:
OCc1cccc(c1)c1ccc2c(c1)CC(=O)N2
Properties
Complexity:
318
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.095g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
239.274g/mol
Monoisotopic Mass:
239.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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