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Trimethyl orthovalerate

CAS 13820-09-2CH3CH2CH2CH2C(OCH3)3Chemical Synthesis

Trimethyl orthovalerate (CAS: 13820-09-2), with the molecular formula C8H18O3 and a molecular weight of 162.23 g/mol, is a clear, colourless liquid. This orthoester is a valuable building block in organic synthesis, primarily employed for introducing the valeryl group or as a protecting agent for carbonyl compounds. Its applications extend to the preparation of complex organic molecules and pharmaceutical intermediates.

IUPAC
1,1,1-Trimethoxypentane
Synonyms
1,1,1-Trimethoxypentane
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Trimethyl orthovalerate (CH3CH2CH2CH2C(OCH3)3) — chemical structure, CAS 13820-09-2; Chemistry, fine chemical supplied by Tech Serve Solutions
Acetals/Ketals/Ortho EstersBuilding BlocksChemical SynthesisOrganic Building BlocksOxygen Compounds
01 /Applications

Synthesis of Acyl Derivatives

Trimethyl orthovalerate is utilized in the preparation of various 9-O-acyl derivatives of neuraminic acids, contributing to the synthesis of complex carbohydrates and related compounds.

Preparation of Heterocyclic Compounds

It serves as a precursor in the synthesis of diverse benzimidazolyl-quinazolinone derivatives, enabling the formation of heterocyclic ring systems.

Organic Synthesis Reagent

As an orthoester, it acts as a versatile reagent in organic synthesis, facilitating transformations such as acetalization and the introduction of ester functionalities.

02 /Properties
Molecular weight162.23
Linear formulaCH3CH2CH2CH2C(OCH3)3
Assay97%
Boiling point164-166 °C(lit.)
Density0.941 g/mL at 25 °C(lit.)
Refractive indexn20/D 1.410(lit.)
ApplicationTrimethyl orthovalerate has been used in the preparation of:• various 9-O-acyl derivatives of N-acetyl- and N-glycoloyl-neuraminic acid1• 2-methyl, 2-ethyl, 2-propyl and 2-butyl-3-benzimidazolyl-4(3H)-quinazolinones2
03 /Safety & handling
GHS hazard pictogram: Flammable (GHS02)
Flammable
GHS hazard pictogram: Harmful / irritant (GHS07)
Harmful / irritant
Warning

Hazard statements

  • H226Flammable liquid and vapour
  • H315Causes skin irritation
  • H319Causes serious eye irritation

Precautionary statements

  • P305IF IN EYES
Protective equipmentEyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Flash point42 °C / 107.6 °F
Transport (UN / ADR)UN 3272 3 / PGIII
Water hazard class (WGK, DE)3
Hazard codes (EU)Xi
Risk statements (R)10-36/38
Safety statements (S)26-36

Hazard information is provided for guidance. Always consult the product Safety Data Sheet (SDS), available on request, before handling.

04 /Identifiers & registry
CAS number
13820-09-2
MDL number
MFCD00008481
PubChem substance
24855389
Beilstein registry
1739200
05 /Quality & supply

Documentation

Every batch ships with a Certificate of Analysis covering assay, identity and purity; the grade is confirmed against your enquiry. Safety Data Sheets and technical data sheets are available on request.

Supply & logistics

Samples for technical evaluation; bulk MOQ by grade and packaging. In-stock material ships in 7–10 working days, worldwide, with full export documentation.

06 /Frequently asked questions

What is Trimethyl orthovalerate used for?

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Trimethyl orthovalerate is used as a building block in organic synthesis, notably in the preparation of 9-O-acyl derivatives of neuraminic acids and various benzimidazolyl-quinazolinone structures.

What is the CAS number and molecular formula for Trimethyl orthovalerate?

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The CAS number is 13820-09-2 and the molecular formula is CH3CH2CH2CH2C(OCH3)3.

What grade and purity does Tech Serve Solutions supply?

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Tech Serve Solutions supplies Trimethyl orthovalerate with a minimum assay of 97%. This product is supplied for laboratory and research use and is not represented as USP, BP, EP, or other pharmacopoeia grades.

How should Trimethyl orthovalerate be handled safely?

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Trimethyl orthovalerate is a flammable liquid and vapour (H226) and can cause skin (H315) and serious eye irritation (H319). Handle with appropriate personal protective equipment including eyeshields, gloves, and use in a well-ventilated area. Refer to the Safety Data Sheet for full handling information.

Is Trimethyl orthovalerate exported by Tech Serve Solutions?

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Yes, Tech Serve Solutions is a global supplier and exporter of fine chemicals, including Trimethyl orthovalerate, serving customers worldwide.

How can I request a quote or sample for Trimethyl orthovalerate?

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To request a quote or a sample, please use the contact form on our website or call our sales team, referencing the product name and CAS number 13820-09-2.

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