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Aldehydes & Ketones

4,4-Dimethyl tert-1-en-3-one

Available on request

Buy 4,4-Dimethyl tert-1-en-3-one (CAS 2177-30-2) from Zemixal. Lab and bulk packs, batch COA, fast global delivery. Packs from 100 mg.

Pack sizes
4,4-Dimethyl tert-1-en-3-one chemical structure
CAS number2177-30-2
FormulaC7H12O
Molar mass112.17 g/mol
InChIKeyMUOKXXOKLLKNIE-UHFFFAOYSA-N
IUPAC name4,4-dimethylpent-1-en-3-one

About 4,4-Dimethyl tert-1-en-3-one

4,4-Dimethyl tert-1-en-3-one sits in our aldehydes & Ketones section and ships worldwide from stock or short lead time. For your records, the material is defined by CAS 2177-30-2, formula C7H12O and molar mass 112.17 g/mol.

Use cases we see most often

  • Organic synthesis
  • Condensation & reductive amination
  • API intermediates

Handling and storage

Classified under GHS with signal word Danger and hazard statements H225, H301, H311 and H314. Read the SDS before first use.

Available as 100 mg, 250 mg, 1 g and 5 g. Larger or split packs can be arranged. You receive a batch certificate of analysis and a 16-section SDS with each order. Request pricing online and we confirm availability, documentation and freight to your country.

Typical uses

  • Organic synthesis
  • Condensation & reductive amination
  • API intermediates

Applications

Pharmaceutical Manufacturing and QCResearch Labs and Universities

Specifications and identifiers

Specifications of 4,4-Dimethyl tert-1-en-3-one
Product name4,4-Dimethyl tert-1-en-3-one
Catalogue numberZX-042106
CAS number2177-30-2
IUPAC name4,4-dimethylpent-1-en-3-one
Molecular formulaC7H12O
Molar mass112.17 g/mol
Exact mass112.0888
XLogP31.9
H-bond donors / acceptors0 / 1
Topological polar surface area17.1 Ų
InChIKeyMUOKXXOKLLKNIE-UHFFFAOYSA-N
SMILESCC(C)(C)C(=O)C=C
PubChem CID3014080
Synonyms4,4-Dimethyl-1-penten-3-one, 1-Penten-3-one, 4,4-dimethyl-, 4,4-dimethyl-pent-1-en-3-one, t-butyl vinyl ketone, 2,2-dimethylpent-4-en-3-one

Lot values are stated on the batch certificate of analysis. Ask for a typical COA with your quotation.

Safety and GHS hazards

GHS02 Flammable
Flammable
GHS05 Corrosive
Corrosive
GHS06 Acute toxicity
Acute toxicity

Signal word Danger

  • H225Highly flammable liquid and vapor
  • H301Toxic if swallowed
  • H311Toxic in contact with skin
  • H314Causes severe skin burns and eye damage
  • H331Toxic if inhaled
  • H412Harmful to aquatic life with long lasting effects

Precautionary statements P210, P233, P240, P241, P242, P243, P260, P261, P262, P264, P270, P271, P273, P280, P301 + P316, P301 + P330 + P331, P302 + P352, P302 + P361 + P354, P303 + P361 + P353, P304 + P340, P305 + P354 + P338, P316, P321, P330

Classification summarised from public GHS notifications. It can vary with grade and concentration, so always follow the SDS supplied with your lot.

Pack sizes

Pack sizes of 4,4-Dimethyl tert-1-en-3-one
100 mgQuoted on request
250 mgQuoted on request
1 gQuoted on request
5 gQuoted on request

Need a different size? Bulk drums and custom packing are quoted on request through the quote form on this page.

Questions about 4,4-Dimethyl tert-1-en-3-one

Which CAS number identifies 4,4-Dimethyl tert-1-en-3-one?
4,4-Dimethyl tert-1-en-3-one is registered under CAS 2177-30-2. You may also see it listed as 4,4-Dimethyl-1-penten-3-one, 1-Penten-3-one, 4,4-dimethyl-, 4,4-dimethyl-pent-1-en-3-one. Our catalogue number for this item is ZX-042106.
What are the formula and molar mass of 4,4-Dimethyl tert-1-en-3-one?
For 4,4-Dimethyl tert-1-en-3-one, its formula is C7H12O and its molar mass is 112.17 g/mol. The systematic (IUPAC) name is 4,4-dimethylpent-1-en-3-one. InChIKey MUOKXXOKLLKNIE-UHFFFAOYSA-N lets you match it in any structure database.
What grade and pack sizes are available for 4,4-Dimethyl tert-1-en-3-one?
The grade and assay are confirmed on the quotation and the batch COA. Standard packs are 100 mg, 250 mg, 1 g, 5 g. Larger quantities and custom packing can be quoted on request.
Which documents come with 4,4-Dimethyl tert-1-en-3-one?
Each lot ships with a batch certificate of analysis and a 16-section GHS safety data sheet. A typical COA or specification sheet can be shared with the quotation before you order.
Can Zemixal ship 4,4-Dimethyl tert-1-en-3-one to my country?
Yes. Because 4,4-Dimethyl tert-1-en-3-one is classed as hazardous, it travels in UN-approved packaging as dangerous goods under IATA or IMDG rules, with the export paperwork your broker needs.

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