1-(2-tert-butylcyclohexyl)oxybutan-2-ol

C14H28O2

CAS139504-68-0
GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt

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Identification

CAS Number
139504-68-0
EC Number
412-300-2
UN Number
3082
Index Number
603-154-00-2
PubChem CID
164422

Physical-chemical properties

Molecular Formula
C14H28O2
Molar Mass
228.37 g/mol
IUPAC Name
1-(2-tert-butylcyclohexyl)oxybutan-2-ol

Chemical Identifiers

InChI
InChI=1S/C14H28O2/c1-5-11(15)10-16-13-9-7-6-8-12(13)14(2,3)4/h11-13,15H,5-10H2,1-4H3
InChI Key
GQBVHGLNSHPKPG-UHFFFAOYSA-N

Overview

1-(2-tert-butylcyclohexyl)oxybutan-2-ol (CAS 139504-68-0) is an organic ether compound with specialized industrial applications and environmental classification properties. This chemical compound represents a complex cyclic ether structure featuring a tert-butylcyclohexyl group linked to a butanol moiety through an oxygen bridge. With the molecular formula C14H28O2 and a molecular weight of 228.37 g/mol, this substance exhibits unique structural characteristics that make it valuable for specific industrial processes. The compound is registered under EC number 412-300-2 and is classified under transport regulations as ADR Class 9, indicating it requires special handling considerations during shipping and storage. From a safety perspective, 1-(2-tert-butylcyclohexyl)oxybutan-2-ol carries an Aquatic Chronic 2 hazard classification, requiring the GHS09 environmental hazard pictogram. This classification indicates potential long-term adverse effects on aquatic environments, necessitating careful environmental management practices during handling, use, and disposal. While the compound does not require a signal word under current GHS classification, proper safety protocols must be implemented to prevent environmental release. The compound finds applications in specialized chemical synthesis processes, particularly as an intermediate in the production of complex organic molecules. Its unique ether linkage and bulky substituent groups make it suitable for use in formulation chemistry and as a building block for advanced materials. Unlike structurally different compounds such as 4-[9-(4-amino-3-chlorophenyl)fluoren-9-yl]-2-chloroaniline, which serves in different chemical pathways, this ether compound offers specific reactivity patterns valuable in targeted synthetic applications. OYSI maintains availability of 1-(2-tert-butylcyclohexyl)oxybutan-2-ol for qualified industrial customers across European markets, ensuring reliable supply chain support for specialized chemical manufacturing requirements.

Safety & Classification

Classification:

Aquatic Chronic 2

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H411

Toxic to aquatic life with long lasting effects.

Classification according to CLP Regulation (EC) No 1272/2008. The complete list of hazard and precautionary statements can be found in the Safety Data Sheet (SDS).

First Aid Measures

Transport (ADR)

UN Number3082
ADR Class9
Packing GroupIII
Tunnel Code-
Proper Shipping Name1-[(2-tert-Butyl)cyclohexyl-oxy]-2-butanol
Marine PollutantNo

Frequently Asked Questions

What is 1-(2-tert-butylcyclohexyl)oxybutan-2-ol?

1-(2-tert-butylcyclohexyl)oxybutan-2-ol is an organic chemical compound with the molecular formula C14H28O2 and CAS number 139504-68-0. This substance has a molecular weight of 228.37 g/mol and belongs to the class of ether alcohols, featuring a complex cyclic structure with a tert-butyl group attached to a cyclohexyl ring connected via an oxygen bridge to a butanol chain.

What are the physicochemical properties of 1-(2-tert-butylcyclohexyl)oxybutan-2-ol?

1-(2-tert-butylcyclohexyl)oxybutan-2-ol is a liquid organic compound at room temperature with a molecular weight of 228.37 g/mol. Due to its complex ether-alcohol structure containing both hydrophobic cyclohexyl groups and a hydroxyl function, it likely exhibits moderate polarity and limited water solubility. The presence of the bulky tert-butyl group influences its physical properties and molecular interactions.

What is 1-(2-tert-butylcyclohexyl)oxybutan-2-ol used for?

1-(2-tert-butylcyclohexyl)oxybutan-2-ol is primarily used as a specialty chemical intermediate in industrial synthesis and manufacturing processes. Its unique molecular structure makes it suitable for applications in advanced materials, pharmaceutical intermediates, or as a component in specialized formulations. The compound may also serve as a building block for creating more complex molecules in research and development applications.

How to handle 1-(2-tert-butylcyclohexyl)oxybutan-2-ol safely?

1-(2-tert-butylcyclohexyl)oxybutan-2-ol should be handled with standard laboratory safety precautions including wearing appropriate personal protective equipment such as safety goggles, gloves, and lab coats. Ensure adequate ventilation in the work area and avoid direct skin contact or inhalation. While classified as Aquatic Chronic 2, standard chemical handling procedures should be followed to prevent environmental release and ensure worker safety.

How to store 1-(2-tert-butylcyclohexyl)oxybutan-2-ol correctly?

1-(2-tert-butylcyclohexyl)oxybutan-2-ol should be stored in a cool, dry, well-ventilated area away from direct sunlight and heat sources. Keep containers tightly sealed to prevent contamination and evaporation. Store away from incompatible materials and ensure proper labeling according to GHS requirements. The storage area should have appropriate containment measures to prevent environmental release given its Aquatic Chronic 2 classification.

What to do in case of contact with 1-(2-tert-butylcyclohexyl)oxybutan-2-ol?

In case of skin contact with 1-(2-tert-butylcyclohexyl)oxybutan-2-ol, immediately wash the affected area with plenty of soap and water for at least 15 minutes. For eye contact, rinse thoroughly with clean water for several minutes and remove contact lenses if present. If inhaled, move to fresh air immediately. In case of ingestion, do not induce vomiting and seek immediate medical attention while providing the safety data sheet.

How to dispose of 1-(2-tert-butylcyclohexyl)oxybutan-2-ol appropriately?

1-(2-tert-butylcyclohexyl)oxybutan-2-ol must be disposed of according to local and national environmental regulations due to its Aquatic Chronic 2 classification. Contact licensed waste disposal companies for proper treatment and disposal. Do not discharge to sewers, waterways, or soil. Contaminated containers should also be disposed of through authorized waste management facilities. Follow all applicable waste codes and documentation requirements for hazardous waste disposal.

How to transport 1-(2-tert-butylcyclohexyl)oxybutan-2-ol?

1-(2-tert-butylcyclohexyl)oxybutan-2-ol is classified under ADR Class 9 (Miscellaneous dangerous goods), Packing Group III for transportation purposes. This requires appropriate packaging, labeling, and documentation according to dangerous goods regulations. Containers must be properly sealed and marked with the correct UN identification. Transportation should only be carried out by qualified personnel following all applicable national and international transport regulations for hazardous materials.

Is 1-(2-tert-butylcyclohexyl)oxybutan-2-ol subject to specific regulations?

1-(2-tert-butylcyclohexyl)oxybutan-2-ol is subject to REACH regulation in Europe and must be classified according to CLP regulation with GHS09 pictogram due to its Aquatic Chronic 2 hazard class. The substance is not identified as a Substance of Very High Concern (SVHC). Companies handling this chemical must comply with registration, evaluation, and authorization requirements under REACH and ensure proper classification, labeling, and safety data sheet provisions.

Where to buy 1-(2-tert-butylcyclohexyl)oxybutan-2-ol in Europe?

1-(2-tert-butylcyclohexyl)oxybutan-2-ol is available through OYSI, a specialized European distributor of technical chemicals. OYSI provides this specialty chemical compound to industrial customers across Europe with proper documentation, safety data sheets, and regulatory compliance support. Contact OYSI directly for availability, specifications, and technical support regarding this specialized chemical product for your industrial or research applications.

Data Sources

Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.