2-methyl-4-phenylpentan-1-ol

C12H18O

CAS92585-24-5
GHS07 Gefahrensymbol: Gesundheitsschädlich/Reizend – Ausrufezeichen
GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt
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Identification

CAS Number
92585-24-5
EC Number
402-770-7
UN Number
3082
Index Number
603-092-00-6
PubChem CID
3021997

Physical-chemical properties

Molecular Formula
C12H18O
Molar Mass
178.27 g/mol
IUPAC Name
2-methyl-4-phenylpentan-1-ol

Chemical Identifiers

InChI
InChI=1S/C12H18O/c1-10(9-13)8-11(2)12-6-4-3-5-7-12/h3-7,10-11,13H,8-9H2,1-2H3
InChI Key
SXGYZCMGVZKIPJ-UHFFFAOYSA-N

Overview

2-methyl-4-phenylpentan-1-ol (CAS 92585-24-5) is an organic alcohol compound with a phenyl-substituted pentanol structure and notable sensory properties. This specialized chemical compound, also identified by EC number 402-770-7, belongs to the family of substituted alcohols featuring both aromatic and aliphatic structural elements. With a molecular formula of C12H18O and a molecular weight of 178.27 g/mol, 2-methyl-4-phenylpentan-1-ol presents a unique combination of a phenyl ring attached to a branched pentanol chain, making it particularly valuable in applications requiring specific molecular architecture and sensory characteristics. The compound is classified under GHS regulations with Warning signal word, requiring careful handling due to its skin sensitization properties (Skin Sens. 1) and potential chronic aquatic toxicity (Aquatic Chronic 2). The associated pictograms GHS07 and GHS09 indicate health hazards and environmental concerns respectively. For transportation purposes, it falls under ADR class 9, designating it as a miscellaneous dangerous substance requiring appropriate shipping protocols. In industrial applications, 2-methyl-4-phenylpentan-1-ol is commonly utilized in fragrance formulations where its structural similarity to other aromatic compounds provides specific olfactory properties. The compound also finds use in specialty chemical synthesis and as an intermediate in the production of complex organic molecules. Its applications sometimes overlap with related compounds such as 2-phenylsulfanylaniline in specialized chemical processes. The phenyl-substituted structure makes this alcohol particularly suitable for applications requiring both hydrophobic and hydrophilic properties, enabling its use in surfactant formulations and specialty solvent applications. OYSI maintains reliable supply chains for 2-methyl-4-phenylpentan-1-ol, ensuring consistent availability for European industrial customers requiring this specialized chemical intermediate.

Safety & Classification

Warning
Classification:

Skin Sens. 1; Aquatic Chronic 2

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H317

May cause an allergic skin reaction.

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

Skin Contact

Irritant

Measures if substance contacts the skin

First Aid Actions

  • +P302IF ON SKIN:
  • +P352Wash with plenty of water.
  • +P361Take off immediately all contaminated clothing.
  • +P313Get medical advice/attention.

Related hazard statements:

General Measures

Emergency 112 | Poison Control: +49 30 19240 (DE), +33 1 45 42 59 59 (FR), +31 30 274 88 88 (NL)

First aid measures are based on CLP classification and associated P-statements. They do not replace the Safety Data Sheet (SDS). In case of emergency, always consult the full SDS and a physician.

Transport (ADR)

UN Number3082
ADR Class9
Packing GroupIII
Tunnel Code-
Proper Shipping Name2-Methyl-4-phenylpentanol
Marine PollutantNo

Frequently Asked Questions

What is 2-methyl-4-phenylpentan-1-ol?

2-methyl-4-phenylpentan-1-ol is an organic alcohol compound with the molecular formula C12H18O and CAS number 92585-24-5. This substance features a pentanol backbone with a methyl group at position 2 and a phenyl group at position 4, giving it a molecular weight of 178.27 g/mol. It is classified as a skin sensitizer and poses chronic aquatic toxicity risks.

What are the physicochemical properties of 2-methyl-4-phenylpentan-1-ol?

2-methyl-4-phenylpentan-1-ol is a branched alcohol with moderate molecular weight (178.27 g/mol) containing both aliphatic and aromatic structural elements. The presence of the hydroxyl group provides polar characteristics, while the phenyl and methyl substituents contribute to its hydrophobic properties. Its structure suggests it would be a liquid at room temperature with limited water solubility due to its predominantly hydrocarbon nature.

What is 2-methyl-4-phenylpentan-1-ol used for?

2-methyl-4-phenylpentan-1-ol serves as a specialty chemical intermediate in organic synthesis and pharmaceutical manufacturing. Its unique branched structure with phenyl substitution makes it valuable for producing complex molecules, potential fragrance compounds, and as a building block in fine chemical synthesis. The alcohol functionality allows for further derivatization in various industrial applications requiring specific molecular architectures.

How to handle 2-methyl-4-phenylpentan-1-ol safely?

2-methyl-4-phenylpentan-1-ol requires careful handling due to its skin sensitization properties (Skin Sens. 1). Use appropriate personal protective equipment including chemical-resistant gloves, safety glasses, and protective clothing to prevent skin contact. Ensure adequate ventilation in work areas and avoid generating aerosols. Follow standard laboratory hygiene practices and have emergency eyewash and shower facilities readily available.

How to store 2-methyl-4-phenylpentan-1-ol correctly?

2-methyl-4-phenylpentan-1-ol should be stored in tightly sealed containers in a cool, dry, well-ventilated area away from heat sources and direct sunlight. Keep containers upright and properly labeled with hazard information. Store away from incompatible materials and ensure storage areas are equipped with appropriate spill containment measures. Regular inspection of containers for leaks or damage is recommended.

What to do in case of contact with 2-methyl-4-phenylpentan-1-ol?

Skin contact with 2-methyl-4-phenylpentan-1-ol requires immediate removal of contaminated clothing and thorough washing with soap and water for at least 15 minutes due to its sensitizing properties. For eye contact, rinse immediately with clean water for 15 minutes while holding eyelids open. If inhaled, move to fresh air. Seek medical attention if irritation persists or allergic reactions develop.

How to dispose of 2-methyl-4-phenylpentan-1-ol appropriately?

2-methyl-4-phenylpentan-1-ol must be disposed of according to local and national hazardous waste regulations due to its classification as Aquatic Chronic 2. Contact licensed waste disposal companies for proper treatment and disposal. Do not discharge to sewers, waterways, or soil. Small quantities may require collection and incineration at authorized facilities. Maintain disposal records as required by environmental regulations.

How to transport 2-methyl-4-phenylpentan-1-ol?

2-methyl-4-phenylpentan-1-ol is classified as ADR Class 9 (Miscellaneous dangerous goods), Packing Group III, indicating it requires specific transport regulations. Use approved packaging and labeling according to ADR requirements. Transport vehicles must carry appropriate documentation and emergency response information. Ensure drivers have proper hazmat training and that shipments comply with quantity limitations for this classification.

Is 2-methyl-4-phenylpentan-1-ol subject to specific regulations?

2-methyl-4-phenylpentan-1-ol falls under REACH and CLP regulations in Europe, requiring appropriate classification and labeling as Skin Sens. 1 and Aquatic Chronic 2 with Warning signal word. It is not currently listed as a SVHC substance. Suppliers must provide safety data sheets and ensure proper hazard communication. Users must implement appropriate risk management measures based on the harmonized classification.

Where to buy 2-methyl-4-phenylpentan-1-ol in Europe?

2-methyl-4-phenylpentan-1-ol is available through OYSI, a European distributor of specialty chemicals. OYSI provides this compound with full regulatory compliance including proper classification, labeling, and safety data sheets according to European regulations. As a specialized chemical intermediate, availability may vary based on demand and production schedules. Contact OYSI directly for current availability, specifications, and technical support.

Data Sources

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