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Home > Indoles and Oxindole > 88179-68-4
88179-68-4 | 4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-hydroxy-
CAS No: 88179-68-4 Catalog No: AG004EVP MDL No:
Product Description
Catalog Number:
AG004EVP
Chemical Name:
4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-hydroxy-
CAS Number:
88179-68-4
Molecular Formula:
C8H9NO4
Molecular Weight:
183.1614
IUPAC Name:
2-hydroxy-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindole-1,3-dione
InChI:
InChI=1S/C8H9NO4/c10-7-5-3-1-2-4(13-3)6(5)8(11)9(7)12/h3-6,12H,1-2H2
InChI Key:
SHKHCVKMZYADDO-UHFFFAOYSA-N
SMILES:
ON1C(=O)C2C(C1=O)C1OC2CC1
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.053g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
183.163g/mol
Monoisotopic Mass:
183.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
-1
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