Cyclobutene-1-carboxylic acid (CED0036397)

Record Information

Version

1.0

Creation Date

2026-08-23 00:35:40 UTC

Update Date

2026-08-23 00:35:40 UTC

Accession Number

CHEM224366

Identification

Common Name

Cyclobutene-1-carboxylic acid

Class

Small Molecule

Description

Cyclobutene-1-carboxylic acid is an organic compound with the formula C5H6O2 and an average molecular weight of 98.10 g/mol. Cyclobutene-1-carboxylic acid belongs to the carboxylic acids, a subclass of carboxylic acids and derivatives within the organic compounds. This compound has been identified in or released from 12 recorded sources across several categories. Within the realm of electrical and electronic equipment, it is associated with antennas, auxiliary devices, coils, communication cables or conductors, and electric hearing aids, among four additional sources. It is also found in household cleaning and consumer products, specifically in soap dispensers and tobacco product cases. Additionally, it has been recorded in building and construction materials, specifically in ceilings.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₅H₆O₂

Average Molecular Mass

98.100 g/mol

Monoisotopic Mass

98.037 g/mol

CAS Registry Number

Not Available

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C5H6O2/c6-5(7)4-2-1-3-4/h2H,1,3H2,(H,6,7)

InChI Key

CXUKMALSQXRODE-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
809.0	Log mg/kg	[450:1400]	Rat	LD50	oral	predicted	Not Available

Health Effects

Health Effect	Relationship	Direction	Reference

Exposure Sources

Source ID	Source	Sector	Reference
495	Ceilings	Building & Construction	Not Available
506	Antennas	Electrical & Electronic Equipment	Not Available
507	Auxiliary Devices	Electrical & Electronic Equipment	Not Available
508	Coils	Electrical & Electronic Equipment	Not Available
510	Communication Cables Or Conductors	Electrical & Electronic Equipment	Not Available
516	Electric Hearing Aids	Electrical & Electronic Equipment	Not Available
520	Emergency Protective Devices	Electrical & Electronic Equipment	Not Available
527	Magnets	Electrical & Electronic Equipment	Not Available
533	Sparking Plugs	Electrical & Electronic Equipment	Not Available
539	Video Games	Electrical & Electronic Equipment	Not Available
564	Soap Dispensers	Household cleaning & consumer products	Not Available
567	Tobacco Product Cases	Household cleaning & consumer products	Not Available
585	Canoes And Kayaks	Marine, shipping & aquaculture	Not Available
589	Life Buoys	Marine, shipping & aquaculture	Not Available
592	Marine Propulsion Or Steering	Marine, shipping & aquaculture	Not Available
612	Body Washing Or Cleaning Implements	Personal care & cosmetics	Not Available
616	Face Mask Cosmetics	Personal care & cosmetics	Not Available
634	Buckles	Textiles, leather & furnishings	Not Available
640	Embroidering And Tufting	Textiles, leather & furnishings	Not Available
644	Hook Or Eye Fasteners	Textiles, leather & furnishings	Not Available
647	Multicolour Dyeing	Textiles, leather & furnishings	Not Available
649	Pins Clothes	Textiles, leather & furnishings	Not Available
651	Purses Money Bags Wallets	Textiles, leather & furnishings	Not Available
655	Slide Fasteners	Textiles, leather & furnishings	Not Available
658	Touch Fasteners	Textiles, leather & furnishings	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	Ornithine aminotransferase, mitochondrial	P04181	Humans	Predicted (SEA)	0.0778492
Click to view 3D structure	Carbonic anhydrase 2	P00918	Humans	Predicted (SEA)	802.625
Click to view 3D structure	Carbonic anhydrase 12	O43570	Humans	Predicted (SEA)	549.304
Click to view 3D structure	Carbonic anhydrase 1	P00915	Humans	Predicted (SEA)	663.042
Click to view 3D structure	Carbonic anhydrase 9	Q16790	Humans	Predicted (SEA)	688.654
Click to view 3D structure	Carbonic anhydrase 7	P43166	Humans	Predicted (SEA)	430.818
Click to view 3D structure	Carbonic anhydrase 14	Q9ULX7	Humans	Predicted (SEA)	329.147
Click to view 3D structure	Carbonic anhydrase 6	P23280	Humans	Predicted (SEA)	284.85
Click to view 3D structure	Nicotinate phosphoribosyltransferase	Q6XQN6	Humans	Predicted (SEA)	24.4447
Click to view 3D structure	Carbonic anhydrase 4	P22748	Humans	Predicted (SEA)	417.583
Click to view 3D structure	Carbonic anhydrase 5A, mitochondrial	P35218	Humans	Predicted (SEA)	499.325
Click to view 3D structure	Carbonic anhydrase	Q2PCB5	Dicentrarchus labrax	Predicted (SEA)	11.4438
Click to view 3D structure	Palmitoleoyl-protein carboxylesterase NOTUM	Q8R116	Mus musculus	Predicted (SEA)	8.71911
Click to view 3D structure	Carbonic anhydrase 5B, mitochondrial	Q9Y2D0	Humans	Predicted (SEA)	447.166
Click to view 3D structure	Carbonic anhydrase 3	P07451	Humans	Predicted (SEA)	264.298
Click to view 3D structure	D-amino-acid oxidase	P14920	Humans	Predicted (SEA)	54.8059
Click to view 3D structure	Beta-lactamase	Q44079	Aeromonas hydrophila	Predicted (SEA)	33.7866
Click to view 3D structure	Carbonic anhydrase 15	Q99N23	Mus musculus	Predicted (SEA)	365.736
Click to view 3D structure	Carbonic anhydrase 13	Q9D6N1	Mus musculus	Predicted (SEA)	300.342
Click to view 3D structure	Metallo-beta-lactamase IMP-1	P52699	Serratia marcescens	Predicted (SEA)	32.8524
Click to view 3D structure	4-aminobutyrate aminotransferase, mitochondrial	P80147	Sus scrofa	Predicted (SEA)	0.467095
Click to view 3D structure	D-aspartate oxidase	Q922Z0	Mus musculus	Predicted (SEA)	11.9109
Click to view 3D structure	D-aspartate oxidase	D3ZDM7	Rattus norvegicus	Predicted (SEA)	11.9109
Click to view 3D structure	Advanced glycosylation end product-specific receptor	Q63495	Rattus norvegicus	Predicted (SEA)	42.8171
Click to view 3D structure	Neuraminidase	B4URF0	Influenza A virus	Predicted (SEA)	53.4824