CAS Number3187-58-4
SynonymsMethyl 4,6-dihydroxy-2-methylbenzoate; Benzoic acid, 2,4-dihydroxy-6-methyl-, methyl ester; methyl 2,4-dihydroxy-5-methyl benzoate; orsellinic acid methyl ester; Methyl 2,4-dihydroxy-6-methylbenzoate; 2,4-Dihydroxy-6-methylbenzoic acid methyl ester; Benzoic acid,2,4-dihydroxy-6-methyl-,methyl ester; orsenillic acid; Methyl 2,4-dihydroxy-6-methyl benzoate; Methyl orsellinate
Molecular FormulaC9H10O4
Molecular Weight182.173
Density1.3±0.1 g/cm3
Boiling Point339.1±22.0 °C at 760 mmHg
Melting Point141-142℃
Appearancepowder
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 3187-58-4 |
| Catalog No. | 2A-9065984 |
| Chinese Name | 2,4-二羟基-6-甲基苯甲酸甲酯 |
| Synonyms | Methyl 4,6-dihydroxy-2-methylbenzoate; Benzoic acid, 2,4-dihydroxy-6-methyl-, methyl ester; methyl 2,4-dihydroxy-5-methyl benzoate; orsellinic acid methyl ester; Methyl 2,4-dihydroxy-6-methylbenzoate; 2,4-Dihydroxy-6-methylbenzoic acid methyl ester; Benzoic acid,2,4-dihydroxy-6-methyl-,methyl ester; orsenillic acid; Methyl 2,4-dihydroxy-6-methyl benzoate; Methyl orsellinate |
| Molecular Formula | C9H10O4 |
| Molecular Weight | 182.173 |
| Density | 1.3±0.1 g/cm3 |
| Boiling Point | 339.1±22.0 °C at 760 mmHg |
| Melting Point | 141-142℃ |
| Appearance | powder |
| Storage Condition | 2-8℃, dry, sealed |
| Application | Methyl acetate is a phytotoxic compound with antifungal activity. Ostrichate methyl ester is a 5-lipoxygenase inhibitor with an IC50 value of 59.6μM. Oxinin methyl ester can be used in the study of fu |
| HTC | 2918199090 |
| SMILES | COC(=O)c1c(C)cc(O)cc1O |
| InChI | InChI=1S/C9H10O4/c1-5-3-6(10)4-7(11)8(5)9(12)13-2/h3-4,10-11H,1-2H3 |
| InChI Key | NCCWCZLEACWJIN-UHFFFAOYSA-N |
| Use of | Methyl orsellinate is a phytotoxic compound with antifungal activities. Methyl orsellinate is a 5-lipoxygenase inhibitor with an IC50 value of 59.6 μM. Methyl orsellinate can be used for fungal infection research[1][2]. Properties Name Methyl 2,4-dihydroxy-6-methylbenzoate Synonym More Synonyms Methyl 2,4-dihydroxy-6-methylbenzoate Biological Activity Description Methyl orsellinate is a phytotoxic compound with antifungal activities. Methyl orsellinate is a 5-lipoxygenase inhibitor with an IC50 value of 59.6 μM. Methyl orsellinate can be used for fungal infection research[1][2]. Related Catalog Research Areas >> Infection Signaling Pathways >> Anti-infection >> Fungal Signaling Pathways >> Metabolic Enzyme/Protease >> 5-Lipoxygenase References [1]. Ingólfsdóttir K, et al. Effects of tenuiorin and methyl orsellinate from the lichen Peltigera leucophlebia on 5-/15-lipoxygenases and proliferation of malignant cell lines in vitro. Phytomedicine. 2002 Oct;9(7):654-8. [2]. S. Woodward, et al. Two new antifungal metabolites produced by Sparassis crispa in culture and in decayed trees. Microbiology. 1993. Chemical & Physical Properties Molecular Formula C9H10O4 Exact Mass 182.057907 PSA 66.76000 Index of Refraction 1.578 InChIKey NCCWCZLEACWJIN-UHFFFAOYSA-N Safety Information Hazard Codes Xi HS Code 2918199090 Synthetic Route o-Orsellinic ac... methyl iodide Methyl 2,4-dihy... Literature: Nicolaou; Rodriguez, Rosa Maria; Mitchell, Helen J.; Suzuki, Hideo; Fylaktakidou, Konstantina C.; Baudoin, Olivier; Van Delft, Floris L. Chemistry - A European Journal, 2000 , vol. 6, # 17 p. 3095 - 3115 Methyl acetoace... Methyl 2,4-dihy... Literature: Barrett, Anthony G. M.; Morris, Timothy M.; Barton, Derek H. R. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1980 , p. 2272 - 2277 METHYL 2,4-DIME... Methyl 2,4-dihy... Literature: Mondal, Mukulesh; Puranik, Vedavati G.; Argade, Narshinha P. Journal of Organic Chemistry, 2007 , vol. 72, # 6 p. 2068 - 2076 Precursor & DownStream Precursor 9 CAS#:480-64-8 o-Orsellinic acid CAS#:74-88-4 methyl iodide CAS#:105-45-3 Methyl acetoacetate CAS#:6110-37-8 METHYL 2,4-DIME... DownStream 10 CAS#:488-87-9 2,5-DIMETHYLRES... CAS#:4707-47-5 Atraric acid CAS#:715-33-3 methyl 3,5-dibr... CAS#:6110-37-8 METHYL 2,4-DIME... |
| Tax Rebate | 9.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 30.0% |
| Transport Info | Product name: Summary 2918199090 other carboxylic acids with alcohol function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives. Supervision conditions:None. VAT: 17.0%. Tax rebate rate:9.0%. MFN tariff: 6.5%. General tariff:30.0% |
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