2-Methyl-2-propanyl 4-fluoro-4-(hydroxymethyl)-1-piperidinecarboxylate

Basic Information

View in Editor

CAS Number

614730-97-1

Molecular Formula

C11H20FNO3

Molecular Weight

233.28 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Surfactants Anionic Surfactants

Fine Chemicals Specialty Chemicals UV Stabilizers

Basic Physical Properties

Boiling Point

311℃ at 760 mmHg

Flash Point

141.898℃

SMILES

View in Editor

CC(C)(C)OC(=O)N1CCC(CC1)(CO)F

InChI

InChI=1S/C11H20FNO3/c1-10(2,3)16-9(15)13-6-4-11(12,8-14)5-7-13/h14H,4-8H2,1-3H3

InChIKey

BWZOULIMVKCGII-UHFFFAOYSA-N

LogP

1.7179

Topological Polar Surface Area

49.769999999999996 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

254

Synonyms & References

English

BWZOULIMVKCGII-UHFFFAOYSA-N
614730-97-1
4-fluoro-4-(hydroxymethyl)piperidinecarboxylic acid tert-butyl ester
SCHEMBL321594
CS-W000442
BCP21077
tert-butyl4-fluoro-4-(hydroxymethyl)piperidine-1-carboxylate
FT-0655653
DS-12775
1-Boc-4-fluoro-4-(hydroxymethyl)piperidine
DTXSID90623843
tert-butyl 4-fluoro-4-(hydroxymetyl)piperidine-1-carboxylate
1-PIPERIDINECARBOXYLIC ACID, 4-FLUORO-4-(HYDROXYMETHYL)-, 1,1-DIMETHYLETHYL ESTER
PB12484
tert-butyl 4-fluoro-4-(hydroxymethyl)piperidine-1-carboxylate
MFCD08062513
1-Boc-4-fluoro-4-(hydroxymethyl)-piperidine
AKOS005259433
AM20100497
SY013359
EN300-112764
A8524
4-FLUORO-4-HYDROXYMETHYL-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
1-Boc-4-Fluoro-4-(hydroxymethyl)piperidine
1-BOC-4-FLUORO-4-(HYDROXYMETHYL)-PIPERIDINE
1-Piperidinecarboxylic acid, 4-fluoro-4-(hydroxymethyl)-, 1,1-dimethylethyl ester
tert-Butyl 4-fluoro-4-(hydroxymethyl)piperidine-1-carboxylate
C11H20FNO3
HT145
RW2840
9223AB

MDL Number

MFCD08062513

Customs Code

2933399090

FAQ

What are the physical and chemical properties of 2-Methyl-2-propanyl 4-fluoro-4-(hydroxymethyl)-1-piperidinecarboxylate (CAS: 614730-97-1)?

2-Methyl-2-propanyl 4-fluoro-4-(hydroxymethyl)-1-piperidinecarboxylate is a colorless liquid with a molecular weight of approximately 263.18 g/mol. It has a high solubility in organic solvents but is poorly soluble in water. This compound is known for its reactivity, particularly in nucleophilic substitution reactions. It crystallizes in the form of colorless needles at a specific melting point. It is used in the synthesis of various pharmaceuticals and is characterized by its stability under normal storage conditions.

How is 2-Methyl-2-propanyl 4-fluoro-4-(hydroxymethyl)-1-piperidinecarboxylate (CAS: 614730-97-1) typically synthesized?

2-Methyl-2-propanyl 4-fluoro-4-(hydroxymethyl)-1-piperidinecarboxylate is typically synthesized through a multi-step process involving the protection of a carboxylic acid, followed by a fluoroalkylation reaction. Catalysts such as NaH or other alkali metal hydrides are commonly used. The overall yield is moderate, and the reaction requires precise control of temperature and base concentration to achieve high selectivity and purity. Detailed synthesis protocols and reaction conditions are available in literature and patents.

What industries use 2-Methyl-2-propanyl 4-fluoro-4-(hydroxymethyl)-1-piperidinecarboxylate (CAS: 614730-97-1)?

2-Methyl-2-propanyl 4-fluoro-4-(hydroxymethyl)-1-piperidinecarboxylate is primarily used in the pharmaceutical industry for the synthesis of drug candidates. It also finds applications in the polymer industry for modifying polymer properties and in sensor technology for developing highly sensitive detection systems. Its use in semiconductor manufacturing for specific etching and cleaning processes is also documented, although less common.

What precautions should be taken when handling 2-Methyl-2-propanyl 4-fluoro-4-(hydroxymethyl)-1-piperidinecarboxylate (CAS: 614730-97-1)?

When handling 2-Methyl-2-propanyl 4-fluoro-4-(hydroxymethyl)-1-piperidinecarboxylate, it is essential to wear appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. The compound should be stored in a cool, well-ventilated area away from direct sunlight and fire hazards. Fume hoods should be used during handling to minimize inhalation risks. In case of a spill, it should be contained and disposed of according to local regulations. Safety data sheets (SDS) should be consulted for detailed emergency response procedures.