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Home > Indoles and Oxindole > 41709-84-6
41709-84-6 | 4-ethoxy-2,3-dihydro-1H-isoindole-1,3-dione
CAS No: 41709-84-6 Catalog No: AG01A4SQ MDL No:MFCD20729829
Product Description
Catalog Number:
AG01A4SQ
Chemical Name:
4-ethoxy-2,3-dihydro-1H-isoindole-1,3-dione
CAS Number:
41709-84-6
Molecular Formula:
C10H9NO3
Molecular Weight:
191.1834
MDL Number:
MFCD20729829
IUPAC Name:
4-ethoxyisoindole-1,3-dione
InChI:
InChI=1S/C10H9NO3/c1-2-14-7-5-3-4-6-8(7)10(13)11-9(6)12/h3-5H,2H2,1H3,(H,11,12,13)
InChI Key:
RRUNUZOMEZXGPY-UHFFFAOYSA-N
SMILES:
CCOc1cccc2c1C(=O)NC2=O
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.058g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.186g/mol
Monoisotopic Mass:
191.058g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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