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Home > Indoles and Oxindole > 828-94-4
828-94-4 | 5-Methoxy-2,3-dimethyl-1H-indole
CAS No: 828-94-4 Catalog No: AG004RNK MDL No:MFCD01235888
Product Description
Catalog Number:
AG004RNK
Chemical Name:
5-Methoxy-2,3-dimethyl-1H-indole
CAS Number:
828-94-4
Molecular Formula:
C11H13NO
Molecular Weight:
175.2270
MDL Number:
MFCD01235888
IUPAC Name:
5-methoxy-2,3-dimethyl-1H-indole
InChI:
InChI=1S/C11H13NO/c1-7-8(2)12-11-5-4-9(13-3)6-10(7)11/h4-6,12H,1-3H3
InChI Key:
GZSTUEGIANKNTE-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)c(C)c([nH]2)C
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.1g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
175.231g/mol
Monoisotopic Mass:
175.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Literature
| Title | Journal |
|---|---|
| Indole and its alkyl-substituted derivatives protect erythrocyte and DNA against radical-induced oxidation. | Journal of biochemical and molecular toxicology 20090101 |
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