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Home > Indoles and Oxindole > 109810-82-4
109810-82-4 | 3-(2,3-dimethyl-1H-indol-1-yl)-1,3-dihydro-2-benzofuran-1-one
CAS No: 109810-82-4 Catalog No: AG01F6CS MDL No:
Product Description
Catalog Number:
AG01F6CS
Chemical Name:
3-(2,3-dimethyl-1H-indol-1-yl)-1,3-dihydro-2-benzofuran-1-one
CAS Number:
109810-82-4
Molecular Formula:
C18H15NO2
Molecular Weight:
277.3172
IUPAC Name:
3-(2,3-dimethylindol-1-yl)-3H-2-benzofuran-1-one
InChI:
InChI=1S/C18H15NO2/c1-11-12(2)19(16-10-6-5-7-13(11)16)17-14-8-3-4-9-15(14)18(20)21-17/h3-10,17H,1-2H3
InChI Key:
XVZDDRYMDQYUFQ-UHFFFAOYSA-N
SMILES:
O=C1OC(c2c1cccc2)n1c(C)c(c2c1cccc2)C
Properties
Complexity:
423
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.11g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.323g/mol
Monoisotopic Mass:
277.11g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
31.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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