5-Methoxyindole - CAS 1006-94-6
Catalog: |
BB000297 |
Product Name: |
5-Methoxyindole |
CAS: |
1006-94-6 |
Synonyms: |
1H-Indole, 5-methoxy-; Indole, 5-methoxy-; Femedol; Indol-5-yl methyl ether; NSC 521752 |
IUPAC Name: | 5-methoxy-1H-indole |
Molecular Weight: | 147.17 |
Molecular Formula: | C9H9NO |
Canonical SMILES: | COC1=CC2=C(C=C1)NC=C2 |
InChI: | InChI=1S/C9H9NO/c1-11-8-2-3-9-7(6-8)4-5-10-9/h2-6,10H,1H3 |
InChI Key: | DWAQDRSOVMLGRQ-UHFFFAOYSA-N |
Boiling Point: | 176-178°C |
Melting Point: | 56-58°C |
Purity: | ≥95% |
Density: | 1.169±0.06 g/cm3 |
Appearance: | White to light brownish crystalline powder |
Storage: | Store at 2-8°C |
MDL: | MFCD00005674 |
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 |
WO-2021127302-A1 | 2-(1h-indole-3-carbonyl)-thiazole-4-carboxamide derivatives and related compounds as aryl hydrocarbon receptor (ahr) agonists for the treatment of e.g. angiogenesis implicated or inflammatory disorders | 20191220 |
WO-2021076572-A1 | Ergoline-like compounds for promoting neural plasticity | 20191014 |
WO-2021061801-A1 | Bicyclic inhibitors of cbx chromodomains | 20190924 |
WO-2021045141-A1 | Oligonucleotide deprotection method | 20190904 |
WO-2021013371-A1 | Process for dyeing textiles | 20190722 |
PMID | Publication Date | Title | Journal |
22775213 | 20120801 | Assessment of the pharmacological properties of 5-methoxyindole derivatives at 5-HT4 receptors | The Journal of pharmacy and pharmacology |
22425563 | 20120415 | Prospective acetylcholinesterase inhibitory activity of indole and its analogs | Bioorganic & medicinal chemistry letters |
21837025 | 20110701 | Ethyl 3,3,3-trifluoro-2-hy-droxy-2-(5-meth-oxy-1H-indol-3-yl)propionate | Acta crystallographica. Section E, Structure reports online |
21473625 | 20110512 | 1,6-Dihydro-2H-indeno[5,4-b]furan derivatives: design, synthesis, and pharmacological characterization of a novel class of highly potent MT₂-selective agonists | Journal of medicinal chemistry |
21754466 | 20110501 | 2-(1-Ethyl-5-meth-oxy-1H-indol-3-yl)-N-isopropyl-2-oxoacetamide | Acta crystallographica. Section E, Structure reports online |
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: | 2.1 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Indoles
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS