1,1'-(Dimethoxymethylene)bisbenzene (CED0114308)

Record Information

Version

1.0

Creation Date

2026-04-03 17:56:33 UTC

Update Date

2026-08-19 10:29:49 UTC

SynCED ID

CED0114308

Secondary Accession Numbers

CHEM066896

Identification

Common Name

1,1'-(Dimethoxymethylene)bisbenzene

Class

Small Molecule

Description

1,1'-(Dimethoxymethylene)bisbenzene is an organic compound with the formula C15H16O2 and an average molecular weight of 228.29 g/mol. 1,1'-(Dimethoxymethylene)bisbenzene belongs to the diphenylmethanes, a subclass of benzene and substituted derivatives within the organic compounds. This benzenoid compound has been found in or released from one recorded source: indoor air, dust, and atmospheric transport. The recorded exposure route for this substance is inhalation.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₁₅H₁₆O₂

Average Molecular Mass

228.291 g/mol

Monoisotopic Mass

228.115 g/mol

CAS Registry Number

2235-01-0

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

COC(OC)(C1=CC=CC=C1)C1=CC=CC=C1

InChI Identifier

InChI=1S/C15H16O2/c1-16-15(17-2,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12H,1-2H3

InChI Key

NYRVXYOKUZSUDA-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
2634.0 Log mg/kg [1500:4700]	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
CEDs000019	Indoor air?Indoor air can be a significant reservoir for synthetic chemical contaminants, which often originate from various sources within enclosed environments.	Air, dust & atmospheric transport	Not Available
CEDs000233	Brushes?Brushes used in personal care and cosmetics can be a source of synthetic chemical contamination due to the materials and coatings used in their manufacturing.	Personal care & cosmetics	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
CEDs000615	Eye Makeup Products?Eye makeup products, including mascaras, eyeliners, and eyeshadows, often contain a variety of synthetic chemicals such as pigments, preservatives, and film-forming agents.	Personal care & cosmetics	Not Available
CEDs000618	Lip Makeup Products?Lip makeup products, such as lipsticks, lip glosses, and lip liners, often contain a variety of synthetic chemicals, including pigments, preservatives, and emollients.	Personal care & cosmetics	Not Available
CEDs000632	Apparel?Apparel production often involves the use of various synthetic chemicals, including dyes, finishing agents, and preservatives.	Textiles, leather & furnishings	Not Available
CEDs000642	Footwear?Footwear production often involves the use of various synthetic chemicals, such as adhesives, dyes, and treatments, which can contribute to environmental contamination.	Textiles, leather & furnishings	Not Available
CEDs000643	Headwear?Headwear made from synthetic materials often incorporates chemicals used in the manufacturing and finishing processes, such as dyes, flame retardants, and water repellents.	Textiles, leather & furnishings	Not Available
CEDs000688	Glass Coatings?Glass coatings are synthetic chemical formulations applied to glass surfaces to enhance properties such as durability, UV resistance, and aesthetic appeal.	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
CEDs000734	Coating Compositions?Coating compositions, which include paints, sealants, and varnishes, are formulated with a variety of synthetic chemicals such as solvents, resins, pigments, and additives.	Building & Construction	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
CEDs000740	Paper?Paper production involves the processing of wood fibers and the use of various chemicals, which can lead to synthetic chemical contamination.	Paper, pulp & fiber products	Not Available
CEDs000741	Pigment Pastes?Pigment pastes are concentrated dispersions of pigments used to impart color and properties to materials.	Paper, pulp & fiber products	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	P00918	Humans	Predicted (SEA)	Prediction Confidence Score 0.3 Applicability Domain 0.429 Statistical Significance 0.0459 Supporting Reference Compounds 472 E-value 357.717
Click to view 3D structure	Carbonic anhydrase 9	Q16790	Humans	Predicted (SEA)	Prediction Confidence Score 0.299 Applicability Domain 0.429 Statistical Significance 0.0354 Supporting Reference Compounds 372 E-value 275.353
Click to view 3D structure	Carbonic anhydrase 12	O43570	Humans	Predicted (SEA)	Prediction Confidence Score 0.283 Applicability Domain 0.429 Statistical Significance 0.0481 Supporting Reference Compounds 332 E-value 374.61
Click to view 3D structure	Carbonic anhydrase 7	P43166	Humans	Predicted (SEA)	Prediction Confidence Score 0.271 Applicability Domain 0.429 Statistical Significance 0.0434 Supporting Reference Compounds 242 E-value 337.866
Click to view 3D structure	Voltage-gated inwardly rectifying potassium channel KCNH2	Q12809	Humans	Predicted (SEA)	Prediction Confidence Score 0.262 Applicability Domain 0.313 Statistical Significance 0.4211 Supporting Reference Compounds 1498 E-value 3278.15
Click to view 3D structure	Carbonic anhydrase 14	Q9ULX7	Humans	Predicted (SEA)	Prediction Confidence Score 0.26 Applicability Domain 0.429 Statistical Significance 0.0467 Supporting Reference Compounds 172 E-value 363.789
Click to view 3D structure	Muscarinic acetylcholine receptor M2	P08172	Humans	Predicted (SEA)	Prediction Confidence Score 0.255 Applicability Domain 0.282 Low confidence Statistical Significance 0.1174 Supporting Reference Compounds 373 E-value 913.638
Click to view 3D structure	Muscarinic acetylcholine receptor M3	P20309	Humans	Predicted (SEA)	Prediction Confidence Score 0.255 Applicability Domain 0.282 Low confidence Statistical Significance 0.0966 Supporting Reference Compounds 310 E-value 751.79
Click to view 3D structure	Prostaglandin G/H synthase 1	P23219	Humans	Predicted (SEA)	Prediction Confidence Score 0.252 Applicability Domain 0.296 Low confidence Statistical Significance 0.0496 Supporting Reference Compounds 136 E-value 386.366
Click to view 3D structure	Muscarinic acetylcholine receptor M2	P10980	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.251 Applicability Domain 0.282 Low confidence Statistical Significance 0.0218 Supporting Reference Compounds 98 E-value 169.867
Click to view 3D structure	Carbonic anhydrase 1	P00915	Humans	Predicted (SEA)	Prediction Confidence Score 0.25 Applicability Domain 0.31 Statistical Significance 0.137 Supporting Reference Compounds 407 E-value 1066.53
Click to view 3D structure	Muscarinic acetylcholine receptor M1	Q8WMX0	Bos taurus	Predicted (SEA)	Prediction Confidence Score 0.25 Applicability Domain 0.282 Low confidence Statistical Significance 0.0033 Supporting Reference Compounds 18 E-value 25.3788
Click to view 3D structure	Pancreatic alpha-amylase	P00689	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.249 Applicability Domain 0.282 Low confidence Statistical Significance 0.0014 Supporting Reference Compounds 2 E-value 10.821
Click to view 3D structure	Muscarinic acetylcholine receptor M1	P11229	Humans	Predicted (SEA)	Prediction Confidence Score 0.249 Applicability Domain 0.282 Low confidence Statistical Significance 0.154 Supporting Reference Compounds 385 E-value 1198.64
Click to view 3D structure	Muscarinic acetylcholine receptor M4	P08173	Humans	Predicted (SEA)	Prediction Confidence Score 0.249 Applicability Domain 0.282 Low confidence Statistical Significance 0.116 Supporting Reference Compounds 297 E-value 903.44
Click to view 3D structure	Sodium-dependent dopamine transporter	P23977	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.247 Applicability Domain 0.294 Low confidence Statistical Significance 0.0728 Supporting Reference Compounds 203 E-value 566.82
Click to view 3D structure	Polyunsaturated fatty acid lipoxygenase ALOX15	P12530	Oryctolagus cuniculus	Predicted (SEA)	Prediction Confidence Score 0.247 Applicability Domain 0.296 Low confidence Statistical Significance 0.0075 Supporting Reference Compounds 47 E-value 58.1534
Click to view 3D structure	Transient receptor potential cation channel subfamily A member 1	Q6RI86	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.247 Applicability Domain 0.29 Low confidence Statistical Significance 0.011 Supporting Reference Compounds 56 E-value 85.5563
Click to view 3D structure	Transient receptor potential cation channel subfamily V member 1	Q8NER1	Humans	Predicted (SEA)	Prediction Confidence Score 0.247 Applicability Domain 0.29 Low confidence Statistical Significance 0.0578 Supporting Reference Compounds 104 E-value 449.657
Click to view 3D structure	Cytochrome P450 2D6	P10635	Humans	Predicted (SEA)	Prediction Confidence Score 0.244 Applicability Domain 0.27 Low confidence Statistical Significance 0.5281 Supporting Reference Compounds 1130 E-value 4111.3
Click to view 3D structure	Carbonic anhydrase 4	P22748	Humans	Predicted (SEA)	Prediction Confidence Score 0.241 Applicability Domain 0.273 Low confidence Statistical Significance 0.0754 Supporting Reference Compounds 193 E-value 586.905
Click to view 3D structure	Prostaglandin G/H synthase 2	P35354	Humans	Predicted (SEA)	Prediction Confidence Score 0.241 Applicability Domain 0.281 Low confidence Statistical Significance 0.1203 Supporting Reference Compounds 201 E-value 936.293
Click to view 3D structure	Cytochrome P450 2A5	P20852	Mus musculus	Predicted (SEA)	Prediction Confidence Score 0.241 Applicability Domain 0.286 Low confidence Statistical Significance 0.0019 Supporting Reference Compounds 11 E-value 14.48
Click to view 3D structure	Cytochrome P450 2C19	P33261	Humans	Predicted (SEA)	Prediction Confidence Score 0.24 Applicability Domain 0.27 Low confidence Statistical Significance 0.4829 Supporting Reference Compounds 825 E-value 3759.42
Click to view 3D structure	Aldehyde dehydrogenase 1A1	P51647	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.24 Applicability Domain 0.24 Low confidence Statistical Significance 3.30e-04 Supporting Reference Compounds 1 E-value 2.56902