Methyl 4-methoxyphenylacetate - CAS 23786-14-3

Catalog:	BB018186
Product Name:	Methyl 4-methoxyphenylacetate
CAS:	23786-14-3
Synonyms:	methyl 2-(4-methoxyphenyl)acetate

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Computed Properties

IUPAC Name:	methyl 2-(4-methoxyphenyl)acetate
Description:	Methyl 4-methoxyphenylacetate (CAS# 23786-14-3) is a useful research chemical.
Molecular Weight:	180.20
Molecular Formula:	C10H12O3
Canonical SMILES:	COC1=CC=C(C=C1)CC(=O)OC
InChI:	InChI=1S/C10H12O3/c1-12-9-5-3-8(4-6-9)7-10(11)13-2/h3-6H,7H2,1-2H3
InChI Key:	ZQYLDVNTWDEAJI-UHFFFAOYSA-N
Boiling Point:	158 °C (19 torr)
Density:	1.083 g/cm³
MDL:	MFCD00008454
LogP:	1.41070

Publication Number	Title	Priority Date
CN-113121726-A	Composition containing bisimidazole photoinitiator and application thereof	20210420
WO-2021133749-A1	Substituted piperazine derivatives useful as t cell activators	20191223
US-2021191266-A1	Resin, resist composition and method for producing resist pattern, and compound	20191218
US-2021063875-A1	Salt, quencher, resist composition and method for producing resist pattern	20190829
US-2020385343-A1	Salt, quencher, resist composition and method for producing resist pattern, and method for producing salt	20190604

PMID	Publication Date	Title	Journal
19251422	20090315	Design and synthesis of 4-methoxyphenylacetic acid esters as 15-lipoxygenase inhibitors and SAR comparative studies of them	Bioorganic & medicinal chemistry

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GHS Hazard Statement:	H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
Precautionary Statement:	P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501
Signal Word:	Warning

Complexity:	160
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	180.078644241
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	180.078644241
Rotatable Bond Count:	4
Topological Polar Surface Area:	35.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7