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Home > Indoles and Oxindole > 4722-81-0
4722-81-0 | 5,6-dimethoxy-2,3-dihydro-1H-indole-2,3-dione
CAS No: 4722-81-0 Catalog No: AG019NC6 MDL No:MFCD06496496
Product Description
Catalog Number:
AG019NC6
Chemical Name:
5,6-dimethoxy-2,3-dihydro-1H-indole-2,3-dione
CAS Number:
4722-81-0
Molecular Formula:
C10H9NO4
Molecular Weight:
207.1828
MDL Number:
MFCD06496496
IUPAC Name:
5,6-dimethoxy-1H-indole-2,3-dione
InChI:
InChI=1S/C10H9NO4/c1-14-7-3-5-6(4-8(7)15-2)11-10(13)9(5)12/h3-4H,1-2H3,(H,11,12,13)
InChI Key:
HBNMEXSXIIAELS-UHFFFAOYSA-N
SMILES:
COc1cc2c(cc1OC)NC(=O)C2=O
Properties
Complexity:
291
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.053g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
207.185g/mol
Monoisotopic Mass:
207.053g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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