(1-methylcyclohexyl)methanol (CED0064883)

Record Information

Version

1.0

Creation Date

2026-08-24 17:08:17 UTC

Update Date

2026-08-24 17:08:17 UTC

SynCED ID

CED0064883

Secondary Accession Numbers

CHEM252294

Identification

Common Name

(1-methylcyclohexyl)methanol

Class

Small Molecule

Description

(1-methylcyclohexyl)methanol belongs to the alcohols and polyols, a subclass of organooxygen compounds within the organic compounds. It has the chemical formula C8H16O and an average molecular weight of 128.21 g/mol.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₈H₁₆O

Average Molecular Mass

128.210 g/mol

Monoisotopic Mass

128.120 g/mol

CAS Registry Number

14064-13-2

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C8H16O/c1-8(7-9)5-3-2-4-6-8/h9H,2-7H2,1H3

InChI Key

UUBPRIUBEQJUQL-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
2265.0 Log mg/kg [1300:4000]	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
CEDs000583	Anchoring Equipment?Anchoring equipment, commonly used in marine applications, can be a source of synthetic chemical contamination due to the materials and coatings utilized in their manufacturing.	Marine, shipping & aquaculture	Not Available
CEDs000614	Essential Oils Or Perfumes?Essential oils and perfumes are complex mixtures of volatile compounds derived from natural or synthetic sources, commonly used for their aromatic properties.	Personal care & cosmetics	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	Voltage-dependent calcium channel subunit alpha-2/delta-1	P54290	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.266 Applicability Domain 0.31 Statistical Significance 6.00e-05 Supporting Reference Compounds 2 E-value 0.467095
Click to view 3D structure	Glyceraldehyde-3-phosphate dehydrogenase	P46406	Oryctolagus cuniculus	Predicted (SEA)	Prediction Confidence Score 0.235 Applicability Domain 0.235 Low confidence Statistical Significance 3.00e-05 Supporting Reference Compounds 1 E-value 0.233548
Click to view 3D structure	Sodium-dependent serotonin transporter	P31645	Humans	Predicted (SEA)	Prediction Confidence Score 0.231 Applicability Domain 0.261 Low confidence Statistical Significance 0.3593 Supporting Reference Compounds 593 E-value 2796.89
Click to view 3D structure	Sodium-dependent noradrenaline transporter	P23975	Humans	Predicted (SEA)	Prediction Confidence Score 0.231 Applicability Domain 0.261 Low confidence Statistical Significance 0.3057 Supporting Reference Compounds 451 E-value 2380.24
Click to view 3D structure	Sodium-dependent serotonin transporter	P31652	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.221 Applicability Domain 0.233 Low confidence Statistical Significance 0.2462 Supporting Reference Compounds 297 E-value 1916.96
Click to view 3D structure	Alpha-1A adrenergic receptor	P43140	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.221 Applicability Domain 0.233 Low confidence Statistical Significance 0.2152 Supporting Reference Compounds 208 E-value 1675.47
Click to view 3D structure	Norepinephrine transporter	Q9WTR4	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.197 Applicability Domain 0.233 Low confidence Statistical Significance 0.2223 Supporting Reference Compounds 112 E-value 1730.82
Click to view 3D structure	Muscarinic acetylcholine receptor M2	P08172	Humans	Predicted (SEA)	Prediction Confidence Score 0.196 Applicability Domain 0.261 Low confidence Statistical Significance 0.7133 Supporting Reference Compounds 373 E-value 5553.06
Click to view 3D structure	Voltage-dependent calcium channel alpha2delta subunit	O77773	Sus scrofa	Predicted (SEA)	Prediction Confidence Score 0.196 Applicability Domain 0.31 Statistical Significance 1.00e-04 Supporting Reference Compounds 4 E-value 0.778492
Click to view 3D structure	Sodium-dependent dopamine transporter	Q01959	Humans	Predicted (SEA)	Prediction Confidence Score 0.192 Applicability Domain 0.231 Low confidence Statistical Significance 0.8293 Supporting Reference Compounds 506 E-value 6455.72
Click to view 3D structure	Sucrase-isomaltase, intestinal	P23739	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.191 Applicability Domain 0.242 Low confidence Statistical Significance 0.0029 Supporting Reference Compounds 25 E-value 22.5763
Click to view 3D structure	Prostaglandin reductase 1	P97584	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.19 Applicability Domain 0.19 Low confidence Statistical Significance 1.00e-04 Supporting Reference Compounds 1 E-value 0.778492
Click to view 3D structure	Sodium-dependent dopamine transporter	P23977	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.185 Applicability Domain 0.214 Low confidence Statistical Significance 0.4878 Supporting Reference Compounds 203 E-value 3797.49
Click to view 3D structure	Delta-type opioid receptor	P41143	Humans	Predicted (SEA)	Prediction Confidence Score 0.184 Applicability Domain 0.261 Low confidence Statistical Significance 0.804 Supporting Reference Compounds 427 E-value 6259.08
Click to view 3D structure	Alpha-glucosidase MAL12	P53341	Saccharomyces cerevisiae S288c	Predicted (SEA)	Prediction Confidence Score 0.182 Applicability Domain 0.182 Low confidence Statistical Significance 0.0017 Supporting Reference Compounds 1 E-value 13.3122
Click to view 3D structure	Sigma non-opioid intracellular receptor 1	Q99720	Humans	Predicted (SEA)	Prediction Confidence Score 0.182 Applicability Domain 0.214 Low confidence Statistical Significance 0.8978 Supporting Reference Compounds 562 E-value 6989.46
Click to view 3D structure	Transporter	Q63380	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.178 Applicability Domain 0.233 Low confidence Statistical Significance 0.2774 Supporting Reference Compounds 54 E-value 2159.3
Click to view 3D structure	Maltase-glucoamylase	O43451	Humans	Predicted (SEA)	Prediction Confidence Score 0.178 Applicability Domain 0.242 Low confidence Statistical Significance 0.0173 Supporting Reference Compounds 30 E-value 134.601
Click to view 3D structure	Beta-lactoglobulin	P02754	Bos taurus	Predicted (SEA)	Prediction Confidence Score 0.176 Applicability Domain 0.196 Low confidence Statistical Significance 0.0013 Supporting Reference Compounds 2 E-value 10.4318
Click to view 3D structure	Muscarinic acetylcholine receptor M3	P20309	Humans	Predicted (SEA)	Prediction Confidence Score 0.175 Applicability Domain 0.261 Low confidence Statistical Significance 0.8819 Supporting Reference Compounds 310 E-value 6865.37
Click to view 3D structure	Alpha-galactosidase	Q42656	Coffea arabica	Predicted (SEA)	Prediction Confidence Score 0.174 Applicability Domain 0.242 Low confidence Statistical Significance 0.0037 Supporting Reference Compounds 12 E-value 28.8042
Click to view 3D structure	D(3) dopamine receptor	P35462	Humans	Predicted (SEA)	Prediction Confidence Score 0.173 Applicability Domain 0.261 Low confidence Statistical Significance 0.9553 Supporting Reference Compounds 861 E-value 7437.17
Click to view 3D structure	Acetylcholinesterase	P22303	Humans	Predicted (SEA)	Prediction Confidence Score 0.172 Applicability Domain 0.192 Low confidence Statistical Significance 0.9107 Supporting Reference Compounds 406 E-value 7090.12
Click to view 3D structure	Muscarinic acetylcholine receptor M2	P10980	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.172 Applicability Domain 0.214 Low confidence Statistical Significance 0.5205 Supporting Reference Compounds 98 E-value 4052.44
Click to view 3D structure	Muscarinic acetylcholine receptor M4	P08173	Humans	Predicted (SEA)	Prediction Confidence Score 0.172 Applicability Domain 0.261 Low confidence Statistical Significance 0.8903 Supporting Reference Compounds 297 E-value 6930.6