(2,2-Dimethyl-1,3-dioxolan-4-yl)methyl methacrylate (CED0045270)

Record Information

Version

1.0

Creation Date

2026-04-04 19:41:08 UTC

Update Date

2026-08-18 02:05:54 UTC

SynCED ID

CED0045270

Secondary Accession Numbers

CHEM079789

Identification

Common Name

(2,2-Dimethyl-1,3-dioxolan-4-yl)methyl methacrylate

Class

Small Molecule

Description

(2,2-Dimethyl-1,3-dioxolan-4-yl)methyl methacrylate is an organic oxygen compound with the chemical formula C10H16O4 and an average molecular weight of 200.23 g/mol. (2,2-Dimethyl-1,3-dioxolan-4-yl)methyl methacrylate belongs to the ethers, a subclass of organooxygen compounds within the organic compounds. In industrial applications, this compound serves several roles, functioning as a binder and a film former. Additionally, it is utilized as a softener and conditioner.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₁₀H₁₆O₄

Average Molecular Mass

200.234 g/mol

Monoisotopic Mass

200.105 g/mol

CAS Registry Number

7098-80-8

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

CC(=C)C(=O)OCC1COC(C)(C)O1

InChI Identifier

InChI=1/C10H16O4/c1-7(2)9(11)12-5-8-6-13-10(3,4)14-8/h8H,1,5-6H2,2-4H3

InChI Key

JPFPDGRVRGETED-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

Toxicity Values

Toxicity Value	Organism	Dose Descriptor	Route of Exposure	Predicted or Experimental	Toxicity Rating	Reference
8974.0 Log mg/kg [5000:16000]	Rat	LD50	oral	predicted	Not Available	Not Available

Toxicity / Toxin Class

Not Available

Mechanism of Toxicity

Not Available

Carcinogenicity (IARC Classification)

Not Available

Minimum Risk Level

Not Available

Symptoms

Not Available

Treatment

Not Available

Health Effects

Health Effect	Relationship	Direction	Reference

Exposure Sources

Source ID	Source	Sector	Reference
CEDs000070	Stormwater runoff?Stormwater runoff refers to the flow of rainwater or melted snow that does not soak into the ground and instead collects pollutants as it travels over impervious surfaces such as roads and parking lots.	Automotive & urban infrastructure	Not Available
CEDs000511	Conductors Or Conductive Bodies Characterised By The Conductive Materials?Conductors, or conductive bodies, are materials that allow the flow of electrical current, typically made from metals such as copper, aluminum, or silver.	Electrical & Electronic Equipment	Not Available
CEDs000693	Silica Glass?Silica glass, primarily composed of silicon dioxide (SiO2), is widely used in various applications, including windows, glass facades, and insulation materials.	Building & Construction	Not Available
CEDs000696	Nanotechnology?Nanotechnology involves the manipulation of materials at the molecular or atomic level, typically within the range of 1 to 100 nanometers.	Industrial manufacturing & chemical processing	Not Available
CEDs000739	Inks?Inks are complex mixtures composed of pigments or dyes, solvents, resins, and additives used primarily for printing and writing applications.	Paper, pulp & fiber products	Not Available
CEDs000744	Water, Wastewater, & Sewage Treatment?Water, wastewater, and sewage treatment processes are critical for managing and mitigating pollutants in water systems.	Wastewater, sanitation & biosolids	Not Available

Pathways

0 pathwaysPathway Source: PathBank

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	Carbonic anhydrase 2	P27139	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.224 Applicability Domain 0.224 Low confidence Statistical Significance 7.00e-05 Supporting Reference Compounds 1 E-value 0.544945
Click to view 3D structure	Cytochrome P450 2A2	P15149	Rat	Predicted (SEA)	Prediction Confidence Score 0.222 Applicability Domain 0.222 Low confidence Statistical Significance 0.0082 Supporting Reference Compounds 3 E-value 63.6807
Click to view 3D structure	Lanosterol 14-alpha demethylase	Q4PJW3	Bos taurus	Predicted (SEA)	Prediction Confidence Score 0.222 Applicability Domain 0.222 Low confidence Statistical Significance 0.0082 Supporting Reference Compounds 1 E-value 63.6028
Click to view 3D structure	Cholesterol side-chain cleavage enzyme, mitochondrial	P14137	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.222 Applicability Domain 0.222 Low confidence Statistical Significance 0.0082 Supporting Reference Compounds 3 E-value 63.6807
Click to view 3D structure	Cytochrome P450 7A1	P18125	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.222 Applicability Domain 0.222 Low confidence Statistical Significance 0.0082 Supporting Reference Compounds 3 E-value 63.6807
Click to view 3D structure	Carnitine palmitoyltransferase 1A	Q9MYX2	Sus scrofa	Predicted (SEA)	Prediction Confidence Score 0.211 Applicability Domain 0.217 Low confidence Statistical Significance 0.0037 Supporting Reference Compounds 2 E-value 29.0378
Click to view 3D structure	CD81 antigen	P60033	Humans	Predicted (SEA)	Prediction Confidence Score 0.208 Applicability Domain 0.208 Low confidence Statistical Significance 2.30e-04 Supporting Reference Compounds 1 E-value 1.79053
Click to view 3D structure	Cytochrome P450 3A4	P08684	Humans	Predicted (SEA)	Prediction Confidence Score 0.205 Applicability Domain 0.222 Low confidence Statistical Significance 0.9305 Supporting Reference Compounds 1538 E-value 7243.95
Click to view 3D structure	Asialoglycoprotein receptor 1	P07306	Humans	Predicted (SEA)	Prediction Confidence Score 0.2 Applicability Domain 0.2 Low confidence Statistical Significance 7.50e-04 Supporting Reference Compounds 1 E-value 5.83869
Click to view 3D structure	5-hydroxytryptamine receptor 1A	P08908	Humans	Predicted (SEA)	Prediction Confidence Score 0.198 Applicability Domain 0.233 Low confidence Statistical Significance 0.8232 Supporting Reference Compounds 953 E-value 6408.24
Click to view 3D structure	Alpha-1D adrenergic receptor	P25100	Humans	Predicted (SEA)	Prediction Confidence Score 0.194 Applicability Domain 0.233 Low confidence Statistical Significance 0.5999 Supporting Reference Compounds 258 E-value 4669.94
Click to view 3D structure	Glycine receptor subunit alpha-2	P22771	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.194 Applicability Domain 0.194 Low confidence Statistical Significance 9.00e-05 Supporting Reference Compounds 1 E-value 0.700643
Click to view 3D structure	Steroid 21-hydroxylase	P08686	Humans	Predicted (SEA)	Prediction Confidence Score 0.189 Applicability Domain 0.222 Low confidence Statistical Significance 0.072 Supporting Reference Compounds 26 E-value 560.514
Click to view 3D structure	Carbonic anhydrase 2	P00918	Humans	Predicted (SEA)	Prediction Confidence Score 0.188 Applicability Domain 0.224 Low confidence Statistical Significance 0.7127 Supporting Reference Compounds 472 E-value 5548.31
Click to view 3D structure	Carbonic anhydrase 7	P43166	Humans	Predicted (SEA)	Prediction Confidence Score 0.188 Applicability Domain 0.224 Low confidence Statistical Significance 0.5568 Supporting Reference Compounds 242 E-value 4334.96
Click to view 3D structure	6-phosphogluconate dehydrogenase, decarboxylating	P00349	Ovis aries	Predicted (SEA)	Prediction Confidence Score 0.188 Applicability Domain 0.25 Low confidence Statistical Significance 4.60e-04 Supporting Reference Compounds 2 E-value 3.58106
Click to view 3D structure	Fatty-acid amide hydrolase 1	P97612	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.187 Applicability Domain 0.259 Low confidence Statistical Significance 0.4674 Supporting Reference Compounds 102 E-value 3638.83
Click to view 3D structure	Carbonic anhydrase 9	Q16790	Humans	Predicted (SEA)	Prediction Confidence Score 0.186 Applicability Domain 0.224 Low confidence Statistical Significance 0.6738 Supporting Reference Compounds 372 E-value 5245.25
Click to view 3D structure	Carbonic anhydrase 14	Q9ULX7	Humans	Predicted (SEA)	Prediction Confidence Score 0.186 Applicability Domain 0.224 Low confidence Statistical Significance 0.4745 Supporting Reference Compounds 172 E-value 3694.26
Click to view 3D structure	Lanosterol 14-alpha demethylase	Q64654	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.186 Applicability Domain 0.222 Low confidence Statistical Significance 0.0097 Supporting Reference Compounds 7 E-value 75.2023
Click to view 3D structure	Carbonic anhydrase 5A, mitochondrial	P35218	Humans	Predicted (SEA)	Prediction Confidence Score 0.186 Applicability Domain 0.224 Low confidence Statistical Significance 0.4664 Supporting Reference Compounds 165 E-value 3630.58
Click to view 3D structure	Aromatase	P11511	Humans	Predicted (SEA)	Prediction Confidence Score 0.184 Applicability Domain 0.222 Low confidence Statistical Significance 0.3614 Supporting Reference Compounds 127 E-value 2813.55
Click to view 3D structure	Alpha-1B adrenergic receptor	P35368	Humans	Predicted (SEA)	Prediction Confidence Score 0.184 Applicability Domain 0.233 Low confidence Statistical Significance 0.7764 Supporting Reference Compounds 298 E-value 6044.29
Click to view 3D structure	Carbonic anhydrase 4	P22748	Humans	Predicted (SEA)	Prediction Confidence Score 0.184 Applicability Domain 0.224 Low confidence Statistical Significance 0.5386 Supporting Reference Compounds 193 E-value 4193.19
Click to view 3D structure	Muscarinic acetylcholine receptor M2	P08172	Humans	Predicted (SEA)	Prediction Confidence Score 0.184 Applicability Domain 0.222 Low confidence Statistical Significance 0.8513 Supporting Reference Compounds 373 E-value 6627.07