6-Methoxysalicylic acid - CAS 3147-64-6
Catalog: |
BB020940 |
Product Name: |
6-Methoxysalicylic acid |
CAS: |
3147-64-6 |
Synonyms: |
2-hydroxy-6-methoxybenzoic acid |
Application: |
6-Methoxysalicylic Acid is an intermediate in the synthesis of precursors to radio-iodinated dopamine receptor ligand. |
IUPAC Name: | 2-hydroxy-6-methoxybenzoic acid |
Description: | 6-Methoxysalicylic acid (CAS# 3147-64-6) is an intermediate in the synthesis of precursors to radio-iodinated dopamine receptor ligand. |
Molecular Weight: | 168.15 |
Molecular Formula: | C8H8O4 |
Canonical SMILES: | COC1=CC=CC(=C1C(=O)O)O |
InChI: | InChI=1S/C8H8O4/c1-12-6-4-2-3-5(9)7(6)8(10)11/h2-4,9H,1H3,(H,10,11) |
InChI Key: | AAUQLHHARJUJEH-UHFFFAOYSA-N |
Boiling Point: | 330.4 °C at 760 mmHg |
Purity: | > 98 % |
Density: | 1.351 g/cm3 |
MDL: | MFCD00674090 |
LogP: | 1.09900 |
Quality Standard: | Enterprise Standard |
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-113201037-A | Compound and standard decoction of rhizoma curculiginis containing compound | 20210428 |
WO-2020239658-A1 | Novel compounds and pharmaceutical compositions thereof for the treatment of diseases | 20190529 |
WO-2020239660-A1 | Novel compounds and pharmaceutical compositions thereof for the treatment of diseases | 20190529 |
WO-2020227097-A1 | Kcnt1 inhibitors and methods of use | 20190503 |
JP-2020115163-A | Electrophotographic photoreceptor, image forming apparatus and process cartridge | 20190117 |
PMID | Publication Date | Title | Journal |
19358313 | 20090901 | Rapid and sensitive determination of acetylsalicylic acid and salicylic acid in plasma using liquid chromatography-tandem mass spectrometry: application to pharmacokinetic study | Biomedical chromatography : BMC |
18583074 | 20080813 | Antinociceptive, hypoglycemic and spasmolytic effects of Brickellia veronicifolia | Journal of ethnopharmacology |
16724860 | 20060501 | Phenolic compounds from the roots of Lindera fruticosa | Journal of natural products |
15856407 | 20050401 | Smooth muscle relaxant action of benzyl benzoates and salicylic acid derivatives from Brickellia veronicaefolia on isolated guinea-pig ileum | Planta medica |
Complexity: | 168 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 168.04225873 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 168.04225873 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 66.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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