2,6-dihydroxybenzaldehyde (CED0029729)

Record Information

Version

1.0

Creation Date

2026-08-24 06:06:44 UTC

Update Date

2026-08-24 06:06:44 UTC

Accession Number

CHEM244708

Identification

Common Name

2,6-dihydroxybenzaldehyde

Class

Small Molecule

Description

2,6-dihydroxybenzaldehyde is an organic compound with the chemical formula C7H6O3 and an average molecular weight of 138.12 g/mol. 2,6-dihydroxybenzaldehyde belongs to the carbonyl compounds, a subclass of organooxygen compounds within the organic compounds. This substance is identified as being found in or released from seven recorded sources across various sectors. Within electrical and electronic equipment, it is associated with antennas, auxiliary devices, communication cables or conductors, contacts, and emergency protective devices. Additionally, it has been recorded in building and construction materials, specifically floors, as well as in household items such as coins.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₇H₆O₃

Average Molecular Mass

138.120 g/mol

Monoisotopic Mass

138.032 g/mol

CAS Registry Number

387-46-2

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C7H6O3/c8-4-5-6(9)2-1-3-7(5)10/h1-4,9-10H

InChI Key

DGXAGETVRDOQFP-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

Spectrum Type	Description	Splash Key	Deposition Date	View
Predicted GC-MS	Predicted GC-MS Spectrum	splash10-000i-3900000000-b31dcbfc61b8603c2e30	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-000i-0900000000-a9a40c5f738de1507293	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-000i-0900000000-2b88f54e7ace8ebfd7de	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-01bl-9200000000-46298abdc2ed93d6a949	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-000i-0900000000-01aed0386358fd0064c0	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-052r-0900000000-e32d4550b4cc8c16e666	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0ap3-9500000000-228e7103f70cd9e2addd	Not Available	View Spectrum

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
770.0	Log mg/kg	[430:1400]	Rat	LD50	oral	predicted	Not Available

Health Effects

Health Effect	Relationship	Direction	Reference

Exposure Sources

Source ID	Source	Sector	Reference
497	Floors	Building & Construction	Not Available
506	Antennas	Electrical & Electronic Equipment	Not Available
507	Auxiliary Devices	Electrical & Electronic Equipment	Not Available
510	Communication Cables Or Conductors	Electrical & Electronic Equipment	Not Available
512	Contacts	Electrical & Electronic Equipment	Not Available
520	Emergency Protective Devices	Electrical & Electronic Equipment	Not Available
571	Coins	Household items	Not Available
583	Anchoring Equipment	Marine, shipping & aquaculture	Not Available
592	Marine Propulsion Or Steering	Marine, shipping & aquaculture	Not Available
594	Ship Hulls	Marine, shipping & aquaculture	Not Available
616	Face Mask Cosmetics	Personal care & cosmetics	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	Carbonic anhydrase 2	P00918	Humans	Predicted (SEA)	91.5507
Click to view 3D structure	Carbonic anhydrase 1	P00915	Humans	Predicted (SEA)	143.943
Click to view 3D structure	Carbonic anhydrase 12	O43570	Humans	Predicted (SEA)	127.128
Click to view 3D structure	Polyunsaturated fatty acid lipoxygenase ALOX15	P12530	Oryctolagus cuniculus	Predicted (SEA)	8.56341
Click to view 3D structure	Carbonic anhydrase	Q2PCB5	Dicentrarchus labrax	Predicted (SEA)	2.25763
Click to view 3D structure	Proline racemase	Q9L4Q3	Clostridium sticklandii	Predicted (SEA)	0.389246
Click to view 3D structure	Carbonic anhydrase 6	P23280	Humans	Predicted (SEA)	100.815
Click to view 3D structure	Epidermal growth factor receptor	P00533	Humans	Predicted (SEA)	1147.89
Click to view 3D structure	Indoleamine 2,3-dioxygenase 1	P14902	Humans	Predicted (SEA)	31.6068
Click to view 3D structure	Botulinum neurotoxin type A	P0DPI0	Clostridium botulinum	Predicted (SEA)	2.80257
Click to view 3D structure	Cytochrome P450 1A2	P05177	Humans	Predicted (SEA)	738.088
Click to view 3D structure	Carbonic anhydrase 5B, mitochondrial	Q9Y2D0	Humans	Predicted (SEA)	124.403
Click to view 3D structure	Arachidonate 5-lipoxygenase	Q9BEG3	Bos taurus	Predicted (SEA)	0.544945
Click to view 3D structure	Replicase polyprotein 1ab	P0DTD1	SARS-CoV-2	Predicted (SEA)	168.855
Click to view 3D structure	Catechol O-methyltransferase	Q99028	Sus scrofa	Predicted (SEA)	2.33548
Click to view 3D structure	72 kDa type IV collagenase	P08253	Humans	Predicted (SEA)	589.241
Click to view 3D structure	Tyrosinase	O42713	Agaricus bisporus	Predicted (SEA)	23.6662
Click to view 3D structure	Gag-Pol polyprotein	Q7ZJM1	Human immunodeficiency virus 1	Predicted (SEA)	74.8131
Click to view 3D structure	Polyunsaturated fatty acid 5-lipoxygenase	P12527	Rattus norvegicus	Predicted (SEA)	97.5451
Click to view 3D structure	Carbonic anhydrase 9	Q16790	Humans	Predicted (SEA)	572.114
Click to view 3D structure	Matrix metalloproteinase-9	P14780	Humans	Predicted (SEA)	637.741
Click to view 3D structure	Polyunsaturated fatty acid 5-lipoxygenase	P09917	Humans	Predicted (SEA)	240.943
Click to view 3D structure	Acetylcholinesterase	P22303	Humans	Predicted (SEA)	784.409
Click to view 3D structure	Dual specificity protein phosphatase 3	P51452	Humans	Predicted (SEA)	133.511
Click to view 3D structure	Delta carbonic anhydrase	Q5U9J1	Conticribra weissflogii	Predicted (SEA)	57.7641