6-Methoxyindole - CAS 3189-13-7
Catalog: |
BB021088 |
Product Name: |
6-Methoxyindole |
CAS: |
3189-13-7 |
Synonyms: |
6-methoxy-1H-indole |
IUPAC Name: | 6-methoxy-1H-indole |
Description: | 6-Methoxyindole (CAS# 3189-13-7) is a compound useful in organic synthesis. |
Molecular Weight: | 147.17 |
Molecular Formula: | C9H9NO |
Canonical SMILES: | COC1=CC2=C(C=C1)C=CN2 |
InChI: | InChI=1S/C9H9NO/c1-11-8-3-2-7-4-5-10-9(7)6-8/h2-6,10H,1H3 |
InChI Key: | QJRWYBIKLXNYLF-UHFFFAOYSA-N |
Boiling Point: | 297.8 °C at 760 mmHg |
Melting Point: | 90-94 °C |
Purity: | 95 % |
Density: | 1.169 g/cm3 |
Solubility: | 15.3 [ug/mL] (The mean of the results at pH 7.4) |
Appearance: | White crystalline powder |
Storage: | Keep Cold |
MDL: | MFCD00022780 |
LogP: | 2.17650 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113248524-A | Bisindole alkaloid compound and synthesis method and application thereof | 20210414 |
CN-112574093-A | Novel green method for preparing 3-diaryl methyl substituted indole compound | 20210129 |
CN-112608262-A | Oxalic acid diselenide ester compound and synthesis method and application thereof | 20210112 |
CN-112778280-A | Anthraquinone natural product modified derivative | 20210108 |
CN-112656789-A | Application of FICZ in inhibiting tumor cell migration | 20201231 |
PMID | Publication Date | Title | Journal |
22425563 | 20120415 | Prospective acetylcholinesterase inhibitory activity of indole and its analogs | Bioorganic & medicinal chemistry letters |
22384836 | 20120316 | Iridium-catalyzed C-H borylation-based synthesis of natural indolequinones | The Journal of organic chemistry |
22563433 | 20120101 | Securin enhances the anti-cancer effects of 6-methoxy-3-(3',4',5'-trimethoxy-benzoyl)-1H-indole (BPR0L075) in human colorectal cancer cells | PloS one |
19575780 | 20090703 | Survivin counteracts the therapeutic effect of microtubule de-stabilizers by stabilizing tubulin polymers | Molecular cancer |
18028220 | 20071101 | Time-resolved and steady-state fluorescence spectroscopy of eumelanin and indolic polymers | Photochemistry and photobiology |
Complexity: | 138 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 147.068413911 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 147.068413911 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 25 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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