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Home > Indoles and Oxindole > 919079-22-4
919079-22-4 | 1H-Isoindol-1-one, 2,3-dihydro-4-hydroxy-2-(2-hydroxyethyl)-
CAS No: 919079-22-4 Catalog No: AG0069HG MDL No:
Product Description
Catalog Number:
AG0069HG
Chemical Name:
1H-Isoindol-1-one, 2,3-dihydro-4-hydroxy-2-(2-hydroxyethyl)-
CAS Number:
919079-22-4
Molecular Formula:
C10H11NO3
Molecular Weight:
193.1992
IUPAC Name:
4-hydroxy-2-(2-hydroxyethyl)-3H-isoindol-1-one
InChI:
InChI=1S/C10H11NO3/c12-5-4-11-6-8-7(10(11)14)2-1-3-9(8)13/h1-3,12-13H,4-6H2
InChI Key:
ATJNSFGURKIYPG-UHFFFAOYSA-N
SMILES:
OCCN1Cc2c(C1=O)cccc2O
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.074g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
193.202g/mol
Monoisotopic Mass:
193.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
60.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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