Isopropyl acetoacetate - 98%, high purity , CAS No.542-08-5

  • ≥98%
Item Number
I111058
Grouped product items
SKUSizeAvailabilityPrice Qty
I111058-25g
25g
3
$22.90
I111058-100g
100g
5
$82.90
I111058-500g
500g
Available within 4-8 weeks(?)
Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!
$282.90

Basic Description

SynonymsAKOS000120809 | EC 208-798-4 | Isopropyl 3-Oxobutyrate | SCHEMBL182320 | UNII-38GTB2C6XC | Isopropyl3-oxobutanoate | Isopropyl acetylacetate | acetoacetic acid isopropylester | Isopropyl 3-oxobutanoate | Butanoic acid, 3-oxo-, 1-methylethyl ester | Q27256
Specifications & Purity≥98%
Shipped InNormal
Product Description

Isopropyl acetoacetate can be used as a reactant to synthesize:

· Isopropyl 2-acetyl-3-phenyl-2-propenoate via Knoevenagel reaction in the presence of Ti(O-i-Pr)4.

· Substituted 1,4-dihydropyridines by reacting with cinnamaldehydes and primary amines.

· 5-Isopropoxycarbonyl-6-methyl-4-phenyl-3,4-dihydropyrimidin-2(1H)-thione via Biginelli reaction with benzaldehyde and thiourea

AI Insight

Names and Identifiers

Pubchem Sid488184126
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488184126
IUPAC Name propan-2-yl 3-oxobutanoate
INCHI InChI=1S/C7H12O3/c1-5(2)10-7(9)4-6(3)8/h5H,4H2,1-3H3
InChi Key GVIIRWAJDFKJMJ-UHFFFAOYSA-N
Canonical SMILES CC(C)OC(=O)CC(=O)C
Isomeric SMILES CC(C)OC(=O)CC(=O)C
WGK Germany 1
PubChem CID 68329
Molecular Weight 144.17
Beilstein 1757046
Reaxy-Rn 1757046

Certificates(CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

5 results found

Lot NumberCertificate TypeDateItem
E23151151Certificate of AnalysisApr 06, 2023 I111058
E23151170Certificate of AnalysisApr 06, 2023 I111058
E23151171Certificate of AnalysisApr 06, 2023 I111058
E2315249Certificate of AnalysisApr 06, 2023 I111058
E2315274Certificate of AnalysisApr 06, 2023 I111058

Safety and Hazards(GHS)

Pictogram(s) GHS07
Signal Warning
Hazard Statements

H315:Causes skin irritation

H319:Causes serious eye irritation

H335:May cause respiratory irritation

Precautionary Statements

P261:Avoid breathing dust/fume/gas/mist/vapors/spray.

P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing.

P280:Wear protective gloves/protective clothing/eye protection/face protection.

P302+P352:IF ON SKIN: wash with plenty of water.

P321:Specific treatment (see ... on this label).

P405:Store locked up.

P501:Dispose of contents/container to ...

P264:Wash hands [and …] thoroughly after handling.

P271:Use only outdoors or in a well-ventilated area.

P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing.

P403+P233:Store in a well-ventilated place. Keep container tightly closed.

P362+P364:Take off contaminated clothing and wash it before reuse.

P264+P265:Wash hands [and …] thoroughly after handling. Do not touch eyes.

P337+P317:If eye irritation persists: Get medical help.

P332+P317:If skin irritation occurs: Get medical help.

P319:Get medical help if you feel unwell.

WGK Germany 1
Reaxy-Rn 1757046

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