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Home > Indoles and Oxindole > 26960-67-8
26960-67-8 | 1-(3,4-dimethoxybenzyl)-1H-indole-2,3-dione
CAS No: 26960-67-8 Catalog No: AG00JJOY MDL No:MFCD04000029
Product Description
Catalog Number:
AG00JJOY
Chemical Name:
1-(3,4-dimethoxybenzyl)-1H-indole-2,3-dione
CAS Number:
26960-67-8
Molecular Formula:
C17H15NO4
Molecular Weight:
297.3053
MDL Number:
MFCD04000029
IUPAC Name:
1-[(3,4-dimethoxyphenyl)methyl]indole-2,3-dione
InChI:
InChI=1S/C17H15NO4/c1-21-14-8-7-11(9-15(14)22-2)10-18-13-6-4-3-5-12(13)16(19)17(18)20/h3-9H,10H2,1-2H3
InChI Key:
STAHUAYBNFJQHY-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OC)CN1c2ccccc2C(=O)C1=O
Properties
Complexity:
438
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.1g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.31g/mol
Monoisotopic Mass:
297.1g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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