(2-phenoxyacetyl) 2-phenoxyacetate (CED0052719)

Record Information

Version

1.0

Creation Date

2026-08-19 14:59:27 UTC

Update Date

2026-08-19 14:59:27 UTC

Accession Number

CHEM188001

Identification

Common Name

(2-phenoxyacetyl) 2-phenoxyacetate

Class

Small Molecule

Description

(2-phenoxyacetyl) 2-phenoxyacetate belongs to the phenoxyacetic acid derivatives, a subclass of benzene and substituted derivatives within the organic compounds. It is a member of the benzenoids superclass with the formula C16H14O5 and an average molecular weight of 286.28 g/mol.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₁₆H₁₄O₅

Average Molecular Mass

286.280 g/mol

Monoisotopic Mass

286.084 g/mol

CAS Registry Number

14316-61-1

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C16H14O5/c17-15(11-19-13-7-3-1-4-8-13)21-16(18)12-20-14-9-5-2-6-10-14/h1-10H,11-12H2

InChI Key

CCSBNBKMACZDGN-UHFFFAOYSA-N

Chemical Taxonomy

Classification

Not classified

Biological Properties

Status

Detected and Not Quantified

Origin

Not Available

Cellular Locations

Not Available

Biofluid Locations

Not Available

Tissue Locations

Not Available

Applications

Not Available

Biological Roles

Not Available

Chemical Roles

Not Available

Organoleptic Effects

Not Available

Physical Properties

State

Not Available

Appearance

Not Available

Experimental Properties

Property	Value
Melting Point	Not Available
Boiling Point	Not Available
Solubility	Not Available

Predicted Properties

Not Available

Spectra

Not Available

Toxicity Profile

Mechanism of Toxicity

Not Available

Carcinogenicity (IARC Classification)

Not Available

Minimum Risk Level

Not Available

Symptoms

Not Available

Treatment

Not Available

Toxicity Values

Toxicity Value	Unit	Value Range	Organism	Dose Descriptor	Route of Exposure	Predicted or Experimental	Reference
5243.0	Log mg/kg	[2900:9300]	Rat	LD50	oral	predicted	Not Available

Health Effects

Health Effect	Relationship	Direction	Reference

Exposure Sources

Source ID	Source	Sector	Reference
181	Ballast water	Marine, shipping & aquaculture	Not Available
182	Bilge water	Marine, shipping & aquaculture	Not Available
511	Conductors Or Conductive Bodies Characterised By The Conductive Materials	Electrical & Electronic Equipment	Not Available
519	Electrodes	Electrical & Electronic Equipment	Not Available
696	Nanotechnology	Industrial manufacturing & chemical processing	Not Available
739	Inks	Paper, pulp & fiber products	Not Available
744	Water, Wastewater, & Sewage Treatment	Wastewater, sanitation & biosolids	Not Available

Pathways

0 pathways

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets

Structure	Protein	UniProt ID	Organism	Relationship	Details
Click to view 3D structure	D-amino-acid oxidase	P14920	Humans	Predicted (SEA)	2.64687
Click to view 3D structure	Amine oxidase [flavin-containing] B	P27338	Humans	Predicted (SEA)	102.917
Click to view 3D structure	Acetylcholinesterase	Q6A2E2	Aedes aegypti	Predicted (SEA)	7.16213
Click to view 3D structure	Amine oxidase [copper-containing] 2	O75106	Humans	Predicted (SEA)	2.64687
Click to view 3D structure	Free fatty acid receptor 1	O14842	Humans	Predicted (SEA)	40.1702
Click to view 3D structure	Peroxisome proliferator-activated receptor gamma	P37231	Humans	Predicted (SEA)	94.509
Click to view 3D structure	Peroxisome proliferator-activated receptor alpha	Q07869	Humans	Predicted (SEA)	72.0884
Click to view 3D structure	UDP-3-O-acyl-N-acetylglucosamine deacetylase	O67648	Aquifex aeolicus (strain VF5)	Predicted (SEA)	25.6124
Click to view 3D structure	Adiponectin receptor protein 2	Q86V24	Humans	Predicted (SEA)	36.122
Click to view 3D structure	Adiponectin receptor protein 1	Q96A54	Humans	Predicted (SEA)	36.122
Click to view 3D structure	Carbonic anhydrase 12	O43570	Humans	Predicted (SEA)	214.163
Click to view 3D structure	Polyunsaturated fatty acid 5-lipoxygenase	P12527	Rattus norvegicus	Predicted (SEA)	44.3741
Click to view 3D structure	Penicillin-binding protein 2x	P14677	Streptococcus pneumoniae serotype 4 (strain ATCC BAA-334 / TIGR4)	Predicted (SEA)	0.856341
Click to view 3D structure	Cytochrome P450 3A4	P08684	Humans	Predicted (SEA)	1206.82
Click to view 3D structure	Streptokinase A	P10520	Streptococcus pyogenes serotype M1	Predicted (SEA)	150.015
Click to view 3D structure	Protein deacetylase HDAC6	Q9UBN7	Humans	Predicted (SEA)	502.517
Click to view 3D structure	Amine oxidase [flavin-containing] A	P21397	Humans	Predicted (SEA)	152.818
Click to view 3D structure	Prostaglandin G/H synthase 1	P23219	Humans	Predicted (SEA)	74.891
Click to view 3D structure	Carbonic anhydrase 2	P00918	Humans	Predicted (SEA)	346.896
Click to view 3D structure	Nuclear receptor subfamily 4immunitygroup A member 1	P22736	Humans	Predicted (SEA)	5.44945
Click to view 3D structure	p-hydroxybenzoate hydroxylase	P00438	Pseudomonas fluorescens	Predicted (SEA)	25.6124
Click to view 3D structure	Protein mono-ADP-ribosyltransferase PARP10	Q53GL7	Humans	Predicted (SEA)	25.7681
Click to view 3D structure	Carnitine O-palmitoyltransferase 1, liver isoform	P50416	Humans	Predicted (SEA)	15.7255
Click to view 3D structure	Polyunsaturated fatty acid 5-lipoxygenase	P09917	Humans	Predicted (SEA)	112.959
Click to view 3D structure	Amine oxidase [copper-containing] 3	Q16853	Humans	Predicted (SEA)	5.3716