3-Hydroxy-4-methoxybenzyl alcohol - CAS 4383-06-6
Catalog: |
BB025475 |
Product Name: |
3-Hydroxy-4-methoxybenzyl alcohol |
CAS: |
4383-06-6 |
Synonyms: |
5-(hydroxymethyl)-2-methoxyphenol |
IUPAC Name: | 5-(hydroxymethyl)-2-methoxyphenol |
Description: | 3-Hydroxy-4-methoxybenzyl alcohol (CAS# 4383-06-6 ) is a useful research chemical. |
Molecular Weight: | 154.16 |
Molecular Formula: | C8H10O3 |
Canonical SMILES: | COC1=C(C=C(C=C1)CO)O |
InChI: | InChI=1S/C8H10O3/c1-11-8-3-2-6(5-9)4-7(8)10/h2-4,9-10H,5H2,1H3 |
InChI Key: | WHKRHBLAJFYZKF-UHFFFAOYSA-N |
Boiling Point: | 315.8 °C at 760 mmHg |
Purity: | 98.0 % |
Density: | 1.226 g/cm3 |
Appearance: | Powder |
MDL: | MFCD00004644 |
LogP: | 0.89310 |
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 |
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PMID | Publication Date | Title | Journal |
21125547 | 20110301 | Vanilloid derivatives as tyrosinase inhibitors driven by virtual screening-based QSAR models | Drug testing and analysis |
Complexity: | 116 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 154.062994177 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 154.062994177 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 49.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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