2,5-Dimethoxybenzyl alcohol - CAS 33524-31-1

Catalog:	BB021753
Product Name:	2,5-Dimethoxybenzyl alcohol
CAS:	33524-31-1
Synonyms:	(2,5-dimethoxyphenyl)methanol

Technical Data

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Literatures

Computed Properties

IUPAC Name:	(2,5-dimethoxyphenyl)methanol
Description:	2,5-Dimethoxybenzyl Alcohol can be used as a self-indicating standard for the determination of organolithium reagents.
Molecular Weight:	168.19
Molecular Formula:	C9H12O3
Canonical SMILES:	COC1=CC(=C(C=C1)OC)CO
InChI:	InChI=1S/C9H12O3/c1-11-8-3-4-9(12-2)7(5-8)6-10/h3-5,10H,6H2,1-2H3
InChI Key:	WGQMUABRZGUAOS-UHFFFAOYSA-N
Boiling Point:	305.6 °C at 760 mmHg
Purity:	95 %
Density:	1.173 g/cm³
Appearance:	Clear colorless to light yellow viscous liquid
MDL:	MFCD00004615
LogP:	1.19610

Publication Number	Title	Priority Date
CN-112321413-A	Preparation method of 2, 5-dimethoxy phenylacetic acid	20201028
CN-111514089-A	Oral cavity relieving composition and application and preparation method thereof in oral cavity care product	20200421
CN-111514090-A	Oral cavity relieving composition and application and preparation method thereof in toothpaste	20200421
US-2021189247-A1	Systems and methods for formaldehyde control	20191223
WO-2021130679-A1	Methods for formaldehyde control	20191223

PMID	Publication Date	Title	Journal
22954389	20120917	Mechanistic borderline of one-step hydrogen atom transfer versus stepwise Sc(3+)-coupled electron transfer from benzyl alcohol derivatives to a non-heme iron(IV)-oxo complex	Inorganic chemistry
16915649	20060101	Oxidation capacity of laccases and peroxidases as reflected in experiments with methoxy-substituted benzyl alcohols	Applied biochemistry and biotechnology

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Oxygen Compounds

[544-62-7]
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[1281984-38-0]
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[865774-78-3]
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[202288-73-1]
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Complexity:	127
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:	1
Isotope Atom Count:	0
Monoisotopic Mass:	168.078644241
Rotatable Bond Count:	3
Topological Polar Surface Area:	38.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1