4-Methoxy-α-methylbenzyl alcohol - CAS 3319-15-1
Catalog: |
BB021596 |
Product Name: |
4-Methoxy-α-methylbenzyl alcohol |
CAS: |
3319-15-1 |
Synonyms: |
1-(4-methoxyphenyl)ethanol |
IUPAC Name: | 1-(4-methoxyphenyl)ethanol |
Description: | 4-Methoxy-α-methylbenzyl alcohol (CAS# 3319-15-1) is a useful research chemical. |
Molecular Weight: | 152.19 |
Molecular Formula: | C9H12O2 |
Canonical SMILES: | CC(C1=CC=C(C=C1)OC)O |
InChI: | InChI=1S/C9H12O2/c1-7(10)8-3-5-9(11-2)6-4-8/h3-7,10H,1-2H3 |
InChI Key: | IUUULXXWNYKJSL-UHFFFAOYSA-N |
Boiling Point: | 95 °C (1 torr) |
Density: | 1.079 g/mL at 25 °C(lit.) |
MDL: | MFCD00016857 |
LogP: | 1.74850 |
GHS Hazard Statement: | H227 (33.33%): Combustible liquid [Warning Flammable liquids] |
Precautionary Statement: | P210, P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
22160343 | 20120601 | Stereoselective bioreduction of 1-(4-methoxyphenyl)ethanone by whole cells of marine-derived fungi | Marine biotechnology (New York, N.Y.) |
22271643 | 20120213 | Stereoselective hydride transfer by aryl-alcohol oxidase, a member of the GMC superfamily | Chembiochem : a European journal of chemical biology |
19615417 | 20090910 | Efficient enantioselective reduction of 4'-methoxyacetophenone with immobilized Rhodotorula sp. AS2.2241 cells in a hydrophilic ionic liquid-containing co-solvent system | Journal of biotechnology |
18075700 | 20080107 | Anomalous reactivity of radical cations produced by photosensitized oxidation of 4-methoxybenzyl alcohol derivatives: role of the sensitizer | Physical chemistry chemical physics : PCCP |
16320623 | 20050901 | Volatile compounds in shoulder gland secretions of male flying foxes, genus Pteropus (Pteropodidae, Chiroptera) | Zeitschrift fur Naturforschung. C, Journal of biosciences |
Complexity: | 106 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 152.083729621 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 152.083729621 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 29.5 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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