2-Hexyloxirane

Basic Information

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CAS Number

2984-50-1

Molecular Formula

C8H16O

Molecular Weight

128.22 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Boiling Point

167°C

Water Solubility

Slightly soluble in water.

Refractive Index

n20/D 1.42(lit.)

SMILES

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CCCCCCC1CO1

InChI

InChI=1S/C8H16O/c1-2-3-4-5-6-8-7-9-8/h8H,2-7H2,1H3

InChIKey

NJWSNNWLBMSXQR-UHFFFAOYSA-N

LogP

2.3556

Topological Polar Surface Area

12.53 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

Safety Information

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GHS Hazard Pictograms

H226

H315

H319

H335

Hazard Statement

H226 Flammable liquid and vapor
Flammable liquids

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class 3 Class 3

Sensitiveness

Moisture Sensitive

Synonyms & References

English

1-Octene epoxide
EINECS 221-047-5
NSC24246
2984-50-1
CCRIS 3797
1,2-Epoxyoctane, purum, >=95.0% (GC)
.alpha.-Epoxyoctane
octene oxide
FT-0690325
J-640005
Octane, epoxy-
Oktylenoxid
AS-48232
1,2-Epoxyoctane purum
CS-0152296
n-Hexyloxirane
n-Octene-1,2-oxide
Epoxyoctane
1,2-Epoxyoctane, 96%
E0206
J-640383
2-Hexyloxirane
NSC 24246
F20386
InChI=1/C8H16O/c1-2-3-4-5-6-8-7-9-8/h8H,2-7H2,1H3
1,2-epoxy-octane
SCHEMBL39393
1,2-EPOXYOCTANE
26637-94-5
1,2-Epoxyoktan [Czech]
J-660062

MDL Number

MFCD00005157

Customs Code

2910900090

FAQ

What are the physical and chemical properties of 2-Hexyloxirane (CAS: 2984-50-1)?

2-Hexyloxirane is a colorless liquid with a slight odor. It has a molecular weight of approximately 118.18 g/mol. The compound is slightly soluble in water but miscible with common organic solvents. It is reactive towards nucleophiles and can undergo ring-opening reactions. 2-Hexyloxirane is stable under normal conditions but can polymerize on exposure to heat or light.

How is 2-Hexyloxirane (CAS: 2984-50-1) typically synthesized?

2-Hexyloxirane can be synthesized through a ring-opening reaction of 6-hydroxyhexa-1,3-diol catalyzed by an acid or base. The reaction involves the opening of a cyclic ether to form the corresponding oxirane ring. The yield and selectivity can be controlled by the choice of catalyst and reaction conditions.

What industries use 2-Hexyloxirane (CAS: 2984-50-1)?

2-Hexyloxirane is primarily used in the pharmaceutical industry for the synthesis of certain drugs. It is also used in the polymer industry as a monomer for the preparation of specific polymers. Additionally, it finds applications in the sensor and semiconductor industries due to its ability to form stable complexes with metal ions.

What precautions should be taken when handling 2-Hexyloxirane (CAS: 2984-50-1)?

When handling 2-Hexyloxirane, appropriate personal protective equipment (PPE) such as chemical-resistant gloves, safety goggles, and a lab coat should be worn. The substance should be stored in a cool, dry place away from heat and light. Spills should be cleaned up using appropriate absorbent materials and disposed of according to local regulations. Always refer to the Safety Data Sheet (SDS) for specific handling and emergency procedures.