Cyclododecanol

HCID 15595CAS 1724-39-6
Substructure searchFind similar structures

Basic information

Standard SMILES
OC1CCCCCCCCCCC1
InChIKey
SFVWPXMPRCIVOK-UHFFFAOYSA-N
Molecular formula
C12H24O
Average molar mass
184.32 g/mol
Monoisotopic mass
184.18271539

Overview

cyclododecanol has been reported in Coriandrum sativum with data available.

Names & identifiers

Preferred name
Cyclododecanol
IUPAC
cyclododecanol
English name
CYCLODODECANOL
Molecular formula
C12H24O
Molecular weight
184.32

Names & synonyms

CYCLODODECANOL1724-39-6DTXSID1027429UNII-0Z645Y4JTS0Z645Y4JTSHSDB 5850EINECS 217-031-2NSC 524960NSC-524960CYCLODODECANOL [HSDB]DTXCID707429EC 217-031-2
Show more names
CYCLODODECANOLE1-CyclododecanolCyclododecanol>Cyclododecan-1-olCyclododecanol,99%Cyclododecanol 99%Cyclododecanol, 99% 100GRCYCLODODECANONE FOR SYNTHESIS
RefChem:129455217-031-2SFVWPXMPRCIVOK-UHFFFAOYSA-NMFCD00003717C12H24OCAS-1724-39-6hydroxycyclododecaneNSC524960

Database identifiers

CAS
1724-39-6
PubChem CID
15595
DTXSID
DTXSID1027429
ChEMBL
CHEMBL1872732
UNII
0Z645Y4JTS
EC Number
217-031-2
Nikkaji
J46.185G

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
20.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
13

Experimental & physicochemical properties

PolymersOther Classes -> Alcohols and Polyols, Other
SpringerMaterials PropertiesBoiling point
Vapor Pressure0.000379 [mmHg]
Physical DescriptionSolid; [IUCLID] Fine white crystals; [MSDSonline]

Physicochemical properties

Melting point
77 · 77-78 °C
Boiling point
272.7 °C · 272.7 °C
Density
0.871 · 0.8710 (rough estimate)
vapor pressure
1 hPa · <1 hPa (20 °C)
refractive index
1.55 · 1.5500 (estimate)
Flash point
138 °C · 138 °C

Safety & regulation

GHS classification

GHS Classification · 3 items

H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P273, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 165 reports by companies from 3 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory Information · 3 items

Chemical: Cyclododecanol

Status: Active Update: 24-02-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/11500

Cyclododecanol: Does not have an individual approval but may be used under an appropriate group standard

Hazards Summary · 1 item

Higher alcohols are not highly toxic in the industrial setting; Can cause liver injury, somnolence, and respiratory depression in experimental animals; [HSDB] LD50 (rats) >2.5 g/kg; Not a skin, eye, or mucous membrane irritant; [Ullmann] May cause irritation; [MSDSonline]

Hazard Classes and CategoriesAquatic Chronic 2 (100%)

Toxicology

Adverse EffectsNeurotoxin - Acute solvent syndrome

Safety data

wgk
2
tsca
TSCA listed
ridadr
UN 3077 9/PG 3
hs_code
29061900
Toxicity
LD50 orally in Rabbit: > 2500 mg/kg
risk_code
51/53

Chemistry & industry

Pharmacology

Metabolism/MetabolitesMicrobiological oxygenation of the monocyclic alcohol, cyclododecanol, by Sporotrichum sulfurescens produced a mixture of cylcododecanol dioxygenated products.

Uses & manufacturing

UsesUsed as an intermediate; Its esters and ethers are used as fragrances; [Ullmann]
General Manufacturing InformationCyclododecanol: ACTIVE

Applications

UsesCyclododecanol is a useful reagent for the chemical and antimicrobial studies on the skin of Aloe indica leaves.

Upstream & downstream products

Suppliers50 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]

Related reactions

35 records
New reaction record

Linked notes

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