4-Acetoxybenzyl alcohol - CAS 6309-46-2

Catalog:	BB031995
Product Name:	4-Acetoxybenzyl alcohol
CAS:	6309-46-2
Synonyms:	[4-(hydroxymethyl)phenyl] acetate

Technical Data

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Computed Properties

IUPAC Name:	[4-(hydroxymethyl)phenyl] acetate
Description:	4-Acetoxybenzyl alcohol (CAS# 6309-46-2) is a useful research chemical.
Molecular Weight:	166.17
Molecular Formula:	C9H10O3
Canonical SMILES:	CC(=O)OC1=CC=C(C=C1)CO
InChI:	InChI=1S/C9H10O3/c1-7(11)12-9-4-2-8(6-10)3-5-9/h2-5,10H,6H2,1H3
InChI Key:	FKMVNGWJGSSDCF-UHFFFAOYSA-N
Boiling Point:	289.7 °C at 760 mmHg
Density:	1.179 g/cm³
LogP:	1.10420

Publication Number	Title	Priority Date
US-2021174983-A1	Compositions for the filling of high aspect ratio vertical interconnect access (via) holes	20191204
WO-2021112933-A1	Compositions for the filling of high aspect ratio vertical interconnect access (via) holes	20191204
WO-2021019051-A1	Inhibitors of human atgl	20190730
CN-108191651-A	The preparation method of the visible light catalytic phenol acylation reaction synthesis phenolic ester of thiocarboxylic acid mediation	20180202
CN-108191651-B	Preparation method for synthesizing phenolic ester through thiocarboxylic acid mediated visible light catalytic phenol acylation reaction	20180202

PMID	Publication Date	Title	Journal
22159212	20120207	A spectroscopic off-on probe for simple and sensitive detection of carboxylesterase activity and its application to cell imaging	The Analyst
17915884	20071025	Solid-phase synthesis of symmetrical 5',5'-dinucleoside mono-, di-, tri-, and tetraphosphodiesters	Organic letters
16839180	20060721	Application of a solid-phase beta-triphosphitylating reagent in the synthesis of nucleoside beta-triphosphates	The Journal of organic chemistry
16320998	20051208	Selective diphosphorylation, dithiodiphosphorylation, triphosphorylation, and trithiotriphosphorylation of unprotected carbohydrates and nucleosides	Organic letters
15675883	20050204	Solid-phase reagents for selective monophosphorylation of carbohydrates and nucleosides	The Journal of organic chemistry

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[832740-55-3]
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GHS Hazard Statement:	H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
Precautionary Statement:	P261, P272, P280, P302+P352, P321, P333+P313, P363, and P501
Signal Word:	Warning

Complexity:	148
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	166.062994177
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	166.062994177
Rotatable Bond Count:	3
Topological Polar Surface Area:	46.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.9