2-Methoxyphenylacetic acid - CAS 93-25-4

Catalog:	BB040822
Product Name:	2-Methoxyphenylacetic acid
CAS:	93-25-4
Synonyms:	2-(2-methoxyphenyl)acetic acid

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	2-(2-methoxyphenyl)acetic acid
Description:	2-Methoxyphenylacetic acid (CAS# 93-25-4) is a useful research chemical compound.
Molecular Weight:	166.17
Molecular Formula:	C9H10O3
Canonical SMILES:	COC1=CC=CC=C1CC(=O)O
InChI:	InChI=1S/C9H10O3/c1-12-8-5-3-2-4-7(8)6-9(10)11/h2-5H,6H2,1H3,(H,10,11)
InChI Key:	IVEWTCACRDEAOB-UHFFFAOYSA-N
Boiling Point:	291.3 °C at 760 mmHg
Purity:	98 %
Density:	1.179 g/cm³
Appearance:	White to slightly pink-cream crystalline powder
Storage:	Sealed in dry, Room Temperature
MDL:	MFCD00004321
LogP:	1.32230

Publication Number	Title	Priority Date
CN-112250558-A	Method for preparing carboxylic acid by one-pot method	20201029
US-11155547-B1	Compounds for and methods of treating diseases	20200618
CN-111138370-A	Naphthalene ring-aminopyrimidine compound and preparation method and application thereof	20200210
CN-111205236-A	Naphthalene ring-isoxazole type compound and preparation method and application thereof	20200210
CN-111233766-A	Naphthalene ring-pyrazole compound and preparation method and application thereof	20200210

PMID	Publication Date	Title	Journal
18830129	20090101	Coenzyme Q0 induces apoptosis and modulates the cell cycle in estrogen receptor negative breast cancer cells	Anti-cancer drugs
18540623	20080709	Lipophilic (hydroxy)phenylacetates by solvent-free lipase-catalyzed esterification and transesterification in vacuo	Journal of agricultural and food chemistry
17481906	20070701	Isolation of new phenylacetylingol derivatives that reactivate HIV-1 latency and a novel spirotriterpenoid from Euphorbia officinarum latex	Bioorganic & medicinal chemistry

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Related Functional Groups

Carbonyl Compounds

[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[1427004-19-0]
DBCO-PEG4-NHS ester
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[55441-25-3]
1-(2-Cyanophenyl)urea

GHS Hazard Statement:	H315 (97.83%): 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

Complexity:	156
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:	1.5