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6637-15-6 | 6,7-dimethoxy-3-(2-methyl-1H-indol-3-yl)-1,3-dihydro-2-benzofuran-1-one
CAS No: 6637-15-6 Catalog No: AG01EWU1 MDL No:
Product Description
Catalog Number:
AG01EWU1
Chemical Name:
6,7-dimethoxy-3-(2-methyl-1H-indol-3-yl)-1,3-dihydro-2-benzofuran-1-one
CAS Number:
6637-15-6
Molecular Formula:
C19H17NO4
Molecular Weight:
323.3426
IUPAC Name:
6,7-dimethoxy-3-(2-methyl-1H-indol-3-yl)-3H-2-benzofuran-1-one
InChI:
InChI=1S/C19H17NO4/c1-10-15(11-6-4-5-7-13(11)20-10)17-12-8-9-14(22-2)18(23-3)16(12)19(21)24-17/h4-9,17,20H,1-3H3
InChI Key:
IVHWZGHYLJBMSX-UHFFFAOYSA-N
SMILES:
COc1c(OC)ccc2c1C(=O)OC2c1c(C)[nH]c2c1cccc2
NSC Number:
52366
Properties
Complexity:
484
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.116g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
323.348g/mol
Monoisotopic Mass:
323.116g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
60.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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