4-Hydroxy-3-methoxy-α-methylbenzyl alcohol - CAS 2480-86-6
Catalog: |
BB018627 |
Product Name: |
4-Hydroxy-3-methoxy-α-methylbenzyl alcohol |
CAS: |
2480-86-6 |
Synonyms: |
4-(1-hydroxyethyl)-2-methoxyphenol |
IUPAC Name: | 4-(1-hydroxyethyl)-2-methoxyphenol |
Description: | 4-Hydroxy-3-methoxy-α-methylbenzyl alcohol (CAS# 2480-86-6) is a useful research chemical. |
Molecular Weight: | 168.19 |
Molecular Formula: | C9H12O3 |
Canonical SMILES: | CC(C1=CC(=C(C=C1)O)OC)O |
InChI: | InChI=1S/C9H12O3/c1-6(10)7-3-4-8(11)9(5-7)12-2/h3-6,10-11H,1-2H3 |
InChI Key: | BDRRAMWDUCXAKG-UHFFFAOYSA-N |
Boiling Point: | 301.5 °C at 760 mmHg |
Purity: | ≥ 98 % |
Density: | 1.176 g/cm3 |
MDL: | MFCD00238638 |
LogP: | 1.45410 |
GHS Hazard Statement: | H302 (97.44%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
21870939 | 20111101 | Ethnobotanical survey, chemical composition, and antioxidant capacity of methanolic extract of the root bark of Annona cuneata Oliv | Journal of medicinal food |
19053838 | 20081224 | Decrease of 4-vinylguaiacol during beer aging and formation of apocynol and vanillin in beer | Journal of agricultural and food chemistry |
18588937 | 20080901 | Protective effect of hydroxytyrosol and its metabolite homovanillic alcohol on H(2)O(2) induced lipid peroxidation in renal tubular epithelial cells | Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association |
17019936 | 20060901 | Phenols and lignans from Chenopodium album | Phytochemical analysis : PCA |
12058319 | 20020501 | Cytotoxic terpenoid and immunosuppressive phenolic glycosides from the root bark of Dictamnus dasycarpus | Planta medica |
Complexity: | 138 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 168.078644241 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 168.078644241 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 49.7 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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