1,1,1-Trimethoxypentane

Basic Information

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CAS Number

13820-09-2

Molecular Formula

C8H18O3

Molecular Weight

162.23 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Physical Properties

Melting Point

No data available

Boiling Point

164-166 °C

Refractive Index

n20/D 1.410(lit.)

SMILES

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CCCCC(OC)(OC)OC

InChI

InChI=1S/C8H18O3/c1-5-6-7-8(9-2,10-3)11-4/h5-7H2,1-4H3

InChIKey

XUXVVQKJULMMKX-UHFFFAOYSA-N

LogP

1.7696

Topological Polar Surface Area

27.69 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

81.1

Safety Information

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GHS Hazard Pictograms

H226

H315

H319

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

Hazard Class

Class 3 Class 3

Sensitiveness

Moisture Sensitive

Synonyms & References

English

LS-13546
Trimethyl orthovalerate purum
13820-09-2
Trimethyl orthovalerate, 97%
Trimethyl orthovalerate, purum, >=97.0% (GC)
1,1,1-Trimethoxy-n-pentan
DTXSID4065654
ortho-n-Valeric acid trimethyl ester
Trimethyl orthovalerate
SCHEMBL594044
Orthovaleric acid, trimethyl ester
MFCD00008481
UNII-W0X9MOM6VZ
J-503706
1,1,1-Trimethoxypentane
EN300-7050513
FT-0636965
Orthovaleric Acid Trimethyl Ester
Q27292154
NS00052177
D92429
W0X9MOM6VZ
AKOS015915499
Trimethylorthovalerate
methyl orthovalerate
A807347
TRIMETHYL ORTHOVALERATE [MI]
EINECS 237-496-5
T0981
1,1,1-trimethoxy-pentane
Pentane, 1,1,1-trimethoxy-

MDL Number

MFCD00008481

Customs Code

2909199090

FAQ

What is 1,1,1-Trimethoxypentane (CAS: 13820-09-2)?

1,1,1-Trimethoxypentane (CAS: 13820-09-2) is an organic compound with the chemical formula C8H18O3. It is a colorless liquid with low polarity and is commonly used as a solvent or intermediate in chemical synthesis. This compound is known for its stability under normal conditions and is non-reactive with most substances.

What are the main uses of 1,1,1-Trimethoxypentane (CAS: 13820-09-2)?

1,1,1-Trimethoxypentane (CAS: 13820-09-2) is primarily used in pharmaceutical research as a solvent for organic compounds. It also finds applications in the synthesis of various organic materials, including polymers and fine chemicals. Additionally, it is used in industrial processes and as a component in some specialty coatings and adhesives.

Is 1,1,1-Trimethoxypentane (CAS: 13820-09-2) safe?

1,1,1-Trimethoxypentane (CAS: 13820-09-2) is generally considered safe when handled properly. However, it should be used in well-ventilated areas and with appropriate protective equipment to avoid inhalation or skin contact. Safety data sheets recommend caution in case of accidental exposure and proper disposal methods to ensure environmental safety.

How should 1,1,1-Trimethoxypentane (CAS: 13820-09-2) be stored?

1,1,1-Trimethoxypentane (CAS: 13820-09-2) should be stored in a cool, dry, and well-ventilated place, away from heat and direct light. It is best kept in a sealed, airtight container made of a non-reactive material such as glass or stainless steel to maintain its stability and prevent contamination.