3-Methyl-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-azetidinecarboxylic acid | CAS No. 887591-62-0

3-Methyl-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-azetidinecarboxylic acid

Basic Information

CAS Number

887591-62-0

Molecular Formula

C10H17NO4

Molecular Weight

215.25 g/mol

AD

Basic Physical Properties

Boiling Point

320.8±35.0℃ at 760 mmHg

Density

1.196

CC1(CN(C1)C(=O)OC(C)(C)C)C(=O)O

InChI

InChI=1S/C10H17NO4/c1-9(2,3)15-8(14)11-5-10(4,6-11)7(12)13/h5-6H2,1-4H3,(H,12,13)

InChIKey

FNWBDXQPGAIDQH-UHFFFAOYSA-N

LogP

1.328

Topological Polar Surface Area

66.84 Ų

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

286

Synonyms & References

English

  • 1-(tert-Butoxycarbonyl)-3-methylazetidine-3-carboxylic acid
  • 1-[(tert-butoxy)carbonyl]-3-methylazetidine-3-carboxylic acid
  • A861474
  • PB34717
  • CS-0028255
  • DTXSID70692850
  • AS-36281
  • EN300-153606
  • 3-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]azetidine-3-carboxylic acid
  • FT-0699150
  • 1-(tert-Butoxycarbonyl)-3-methylazetidine-3-carboxylicacid
  • 3-Methyl-azetidine-1,3-dicarboxylic acid mono-tert-butyl ester
  • SY042227
  • 1-Boc-3-methyl-azetidine-3-carboxylic acid
  • FNWBDXQPGAIDQH-UHFFFAOYSA-N
  • 1-BOC-3-METHYLAZETIDINE-3-CARBOXYLIC ACID
  • SCHEMBL13419535
  • AKOS016009004
  • 887591-62-0
  • MFCD12406581
  • AMY38529
  • Z1505697701
  • 1-Boc-3-methylazetidine-3-carboxylic acid
  • 4611AC
  • AK110043
  • ST1010016
  • AB0074801
  • CS-0
  • 1-(1,1-Dimethylethyl) 3-methyl-1,3-azetidinedicarboxylate (ACI)
  • 1-[(tert-Butoxy)carbonyl]-3-methylazetidine-3-carboxylic acid
  • 3-Methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]azetidine-3-carboxylic acid

MDL Number

MFCD12406581

FAQ

What are the physical and chemical properties of 3-Methyl-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-azetidinecarboxylic acid (CAS: 887591-62-0)?

3-Methyl-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-azetidinecarboxylic acid is a white to off-white crystalline solid with a molecular weight of approximately 269.34 g/mol. It is moderately soluble in water and ethanol. The compound is relatively stable but can react with bases and amines. It has a pKa of approximately 5.2, indicating it is a weak acid.

How is 3-Methyl-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-azetidinecarboxylic acid (CAS: 887591-62-0) typically synthesized?

This compound is typically synthesized through the reaction of 2-methyl-2-propanol with 3-azetidinecarboxylic acid, followed by acylation. The reaction is catalyzed by a suitable acid or base, and the yield is generally around 70-80%. The process involves the formation of an ester through an acylation reaction.

What industries use 3-Methyl-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-azetidinecarboxylic acid (CAS: 887591-62-0)?

3-Methyl-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-azetidinecarboxylic acid is used in the pharmaceutical industry for the synthesis of certain drug molecules. It also has potential applications in the polymer industry for the development of new materials. Additionally, it may be used in the sensor industry for developing chemical sensors due to its specific reactivity.

What precautions should be taken when handling 3-Methyl-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-azetidinecarboxylic acid (CAS: 887591-62-0)?

When handling 3-Methyl-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-azetidinecarboxylic acid, it is important to wear appropriate personal protective equipment (PPE) including gloves, goggles, and a lab coat. The compound should be stored in a cool, dry place away from moisture and heat. Spills should be cleaned up using appropriate absorbent materials and the incident should be documented. Always refer to the Safety Data Sheet (SDS) for detailed handling and disposal information.

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