Diisopropyl 3,3-dimethoxy-1,1-cyclobutanedicarboxylate

Basic Information

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CAS Number

115118-68-8

Molecular Formula

C14H24O6

Molecular Weight

288.34 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

92-94 ºC (0.01 Torr)

Flash Point

126.2±27.9 ºC,

SMILES

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COC1(CC(C1)(C(=O)OC(C)C)C(=O)OC(C)C)OC

InChI

InChI=1S/C14H24O6/c1-9(2)19-11(15)13(12(16)20-10(3)4)7-14(8-13,17-5)18-6/h9-10H,7-8H2,1-6H3

InChIKey

SZJMXTBKYMLPTJ-UHFFFAOYSA-N

LogP

1.6588999999999996

Topological Polar Surface Area

71.06 Å²

Hydrogen Bond Donor/Acceptor

0 / 6

Complexity

338

Synonyms & References

English

diisopropyl 3,3-dimethoxycyclobutane-1,1-dicarboxylate
dipropan-2-yl 3,3-dimethoxycyclobutane-1,1-dicarboxylate
3,3-di(isopropoxycarbonyl)-1,1-dimethoxycyclobutane
3,3-dimethoxy-cyclobutane-1,1-dicarboxylic acid diisopropyl ester
AC1NKHBY
bis(1-methylethyl) 3,3-dimethoxycyclobutane-1,1-dicarboxylate
CTK8E2268
PB17382
RP07793
SureCN401326
Diisopropyl 3,3-dimethoxy...
Diisopropy1 3,3-dimethoxycrc1obutane-1
Diisopropyl 3,3-dimethoxycyclobutane-1,1-dicarboxylate - D0238
1,1-bis(propan-2-yl) 3,3-dimethoxycyclobutane-1,1-dicarboxylate
AG120 Intermediates;AG120 Intermediates
SZJMXTBKYMLPTJ-UHFFFAOYSA-N
BCP07007
AK157799
OR317057
AB1011691
Y7117
AM20070570
A803374
diisopropyl3,3-dime

MDL Number

MFCD06742779

FAQ

What are the physical and chemical properties of Diisopropyl 3,3-dimethoxy-1,1-cyclobutanedicarboxylate (CAS: 115118-68-8)?

Diisopropyl 3,3-dimethoxy-1,1-cyclobutanedicarboxylate (CAS: 115118-68-8) is a colorless or yellowish liquid with a molecular weight of approximately 284.43 g/mol. It has a low solubility in water but is soluble in common organic solvents like ethanol and acetonitrile. The compound is moderately reactive, particularly in esterification reactions. It crystallizes easily from certain solvents and is stable under normal storage conditions.

How is Diisopropyl 3,3-dimethoxy-1,1-cyclobutanedicarboxylate (CAS: 115118-68-8) typically synthesized?

Diisopropyl 3,3-dimethoxy-1,1-cyclobutanedicarboxylate (CAS: 115118-68-8) can be synthesized by the reaction of diisopropyl acetals with dimethyl oxalate. The process often involves refluxing these reactants in the presence of a mild base like sodium hydroxide. The yield is typically around 75-85%, and the reaction is highly selective, producing the desired product with minimal side products.

What industries use Diisopropyl 3,3-dimethoxy-1,1-cyclobutanedicarboxylate (CAS: 115118-68-8)?

Diisopropyl 3,3-dimethoxy-1,1-cyclobutanedicarboxylate (CAS: 115118-68-8) is primarily used in the pharmaceutical industry for the synthesis of various compounds, as a precursor in polymer chemistry for the development of new materials, and in the production of sensors and semiconductors. Its unique chemical properties make it valuable in these applications.

What precautions should be taken when handling Diisopropyl 3,3-dimethoxy-1,1-cyclobutanedicarboxylate (CAS: 115118-68-8)?

When handling Diisopropyl 3,3-dimethoxy-1,1-cyclobutanedicarboxylate (CAS: 115118-68-8), it is crucial to work in a well-ventilated area, preferably in a fume hood. Wear appropriate personal protective equipment (PPE), including gloves, safety goggles, and a lab coat. Ensure proper storage in a cool, dry place away from direct sunlight and flammable materials. In case of spillage, immediately clean up using appropriate spill kits and seek medical advice if exposure occurs. Always refer to the Safety Data Sheet (SDS) for further instructions on handling and safety measures.