2583-25-7

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2583-25-7 Structure

Identification	More
[Name] ALLYLMALONIC ACID
[CAS] 2583-25-7
[Synonyms] ALLYLMALONIC ACID AURORA KA-4356 Allylmalonic acid, 98+% 2-propenylpropanedioic acid 2-Allylmalonic acid NSC-46718
[EINECS(EC#)] 219-958-8
[Molecular Formula] C6H8O4
[MDL Number] MFCD00014347
[Molecular Weight] 144.13
[MOL File] 2583-25-7.mol

Chemical Properties	Back Directory
[Melting point ] 102-105 °C
[Boiling point ] 182.71°C (rough estimate)
[density ] 1.1311 (rough estimate)
[refractive index ] 1.4434 (estimate)
[storage temp. ] 2-8°C
[form ] powder
[pka] 2.85±0.34(Predicted)
[BRN ] 1766382
[InChI] 1S/C6H8O4/c1-2-3-4(5(7)8)6(9)10/h2,4H,1,3H2,(H,7,8)(H,9,10)
[InChIKey] ZDZVKPXKLLLOOA-UHFFFAOYSA-N
[SMILES] OC(=O)C(CC=C)C(O)=O
[CAS DataBase Reference] 2583-25-7(CAS DataBase Reference)

Safety Data	Back Directory
[Hazard Codes ] Xi
[Risk Statements ] R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ] S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice . S36:Wear suitable protective clothing .
[WGK Germany ] 3
[Storage Class] 11 - Combustible Solids
[Hazard Classifications] Eye Irrit. 2 Skin Irrit. 2 STOT SE 3

Hazard Information	Back Directory
[Definition] ChEBI: Allylmalonic acid is a branched-chain fatty acid.

Well-known Reagent Company Product Information	Back Directory
[Alfa Aesar] Allylmalonic acid, 98+%(2583-25-7)
[Sigma Aldrich] 2583-25-7(sigmaaldrich)

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