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Home > Indoles and Oxindole > 1249230-82-7
1249230-82-7 | 1H-Indole-2,3-dione, 5-propoxy-
CAS No: 1249230-82-7 Catalog No: AG000MW7 MDL No:
Product Description
Catalog Number:
AG000MW7
Chemical Name:
1H-Indole-2,3-dione, 5-propoxy-
CAS Number:
1249230-82-7
Molecular Formula:
C11H11NO3
Molecular Weight:
205.2099
IUPAC Name:
5-propoxy-1H-indole-2,3-dione
InChI:
InChI=1S/C11H11NO3/c1-2-5-15-7-3-4-9-8(6-7)10(13)11(14)12-9/h3-4,6H,2,5H2,1H3,(H,12,13,14)
InChI Key:
HRKLTQJEVUAZGL-UHFFFAOYSA-N
SMILES:
CCCOc1ccc2c(c1)C(=O)C(=O)N2
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.074g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
205.213g/mol
Monoisotopic Mass:
205.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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