Cyclooctanemethanol

HCID 77196

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Basic information

CAS: 3637-63-6
Standard SMILES: OCC1CCCCCCC1
InChIKey: ZHPBLHYKDKSZCQ-UHFFFAOYSA-N
Molecular formula: C9H18O
Average molar mass: 142.24 g/mol
Monoisotopic mass: 142.1357652

Overview

Cyclooctanemethanol is a primary alcohol.

Names & identifiers

Preferred name: Cyclooctanemethanol
IUPAC: cyclooctylmethanol
English name: Cyclooctanemethanol
Molecular formula: C9H18O
Molecular weight: 142.24

Names & synonyms

CyclooctanemethanolCyclooctylmethanol3637-63-6EINECS 222-862-9NSC 100744AI3-38562DTXSID30189897RefChem:129806DTXCID90112388222-862-9ZHPBLHYKDKSZCQ-UHFFFAOYSA-NCyclooctyl carbinol

Show more names

Cyclooctanemethanol,98%Cyclooctanemethanol,97%(Hydroxymethyl)cyclooctane

MFCD00001749cyclooctylmethan-1-olCYCLO OCTYL CARBINOLhydroxymethylcyclooctaneCYCLOOCTYL METHANOLCyclooctylcarbinolcyclooctane methanolNSC100744

Database identifiers

CAS: 3637-63-6
PubChem CID: 77196
DTXSID: DTXSID30189897
ChEBI: CHEBI:229453
EC Number: 222-862-9
Nikkaji: J205.559G

Properties

Computed structural properties

XLogP: 3
Topological polar surface area: 20.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 10
Formal charge: 0
Complexity: 72.8

Physicochemical properties

Boiling point: 126 °C · 126 °C (22 mmHg)
Density: 0.94 · 0.94
refractive index: 1.483 · 1.483-1.485
Flash point: 93 °C · 93 °C
storage temp.: Store at room temperature
Appearance: Colorless to light yellow Liquid
Water Solubility: It is soluble in water.
Symbol(GHS): 7 · GHS07
Signal word: Danger
Hazard statements: 227 · H227-H315-H319-H335
Precautionary statements: 210 e-P261-P280a-P305+P351+P338-P405-P501a · P210e-P261-P280a-P305+P351+P338-P405-P501a
Risk Statements: 36 · 36/37/38
Safety Statements: 24 · 24/25

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

risk_code: 36/37/38
Signal word: Danger
Symbol(GHS): GHS07
safety_code: 24/25
Hazard statements: H227-H315-H319-H335
Precautionary statements: P210e-P261-P280a-P305+P351+P338-P405-P501a

Chemistry & industry

Applications · 1 item

UsesCyclooctanemethanol is used as a high boiling solvent and heat transfer agent. It is also useful for conversion into plastic and lacquer base materials. Cyclooctanemethanol can be oxidized to cyclooctane carboxylic acid and the acid can be converted into octahydro-2-oxo-1H-azonine (S-aminooctanoic acid lactam), which is a starting material for the production of nylon-8.