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Home > Indoles and Oxindole > 4837-90-5
4837-90-5 | 4-Methoxy-1H-indole
CAS No: 4837-90-5 Catalog No: AG003LNR MDL No:MFCD00009737
Product Description
Catalog Number:
AG003LNR
Chemical Name:
4-Methoxy-1H-indole
CAS Number:
4837-90-5
Molecular Formula:
C9H9NO
Molecular Weight:
147.1739
MDL Number:
MFCD00009737
IUPAC Name:
4-methoxy-1H-indole
InChI:
InChI=1S/C9H9NO/c1-11-9-4-2-3-8-7(9)5-6-10-8/h2-6,10H,1H3
InChI Key:
LUNOXNMCFPFPMO-UHFFFAOYSA-N
SMILES:
COc1cccc2c1cc[nH]2
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.068g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
147.177g/mol
Monoisotopic Mass:
147.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Literature
| Title | Journal |
|---|---|
| Prospective acetylcholinesterase inhibitory activity of indole and its analogs. | Bioorganic & medicinal chemistry letters 20120415 |
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Prediction of genotoxicity of chemical compounds by statistical learning methods. | Chemical research in toxicology 20050601 |
| HPLC and solubility study of the interaction between pindolol and cyclodextrins. | Journal of pharmaceutical and biomedical analysis 20050309 |
| Liquid chromatographic assay for the simultaneous determination of indole-3-carbinol and its acid condensation products in plasma. | Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20030425 |
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