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Home > Indoles and Oxindole > 70097-14-2
70097-14-2 | 1H-Indole-2,3-dione, 1-(2-oxopropyl)-
CAS No: 70097-14-2 Catalog No: AG005Y7R MDL No:MFCD00991620
Product Description
Catalog Number:
AG005Y7R
Chemical Name:
1H-Indole-2,3-dione, 1-(2-oxopropyl)-
CAS Number:
70097-14-2
Molecular Formula:
C11H9NO3
Molecular Weight:
203.1941
MDL Number:
MFCD00991620
IUPAC Name:
1-(2-oxopropyl)indole-2,3-dione
InChI:
InChI=1S/C11H9NO3/c1-7(13)6-12-9-5-3-2-4-8(9)10(14)11(12)15/h2-5H,6H2,1H3
InChI Key:
WVUROUHQGKHFNY-UHFFFAOYSA-N
SMILES:
CC(=O)CN1c2ccccc2C(=O)C1=O
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.058g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.197g/mol
Monoisotopic Mass:
203.058g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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