2-Methyl-2-propanyl [(1R)-1-cyanoethyl]carbamate | CAS No. 100927-09-1

2-Methyl-2-propanyl [(1R)-1-cyanoethyl]carbamate

Basic Information

CAS Number

100927-09-1

Molecular Formula

C8H14N2O2

Molecular Weight

159.23 g/mol

AD

Basic Physical Properties

Boiling Point

277 ºC

Flash Point

121 ºC

CC(C#N)NC(=O)OC(C)(C)C

InChI

InChI=1S/C8H14N2O2/c1-6(5-9)10-7(11)12-8(2,3)4/h6H,1-4H3,(H,10,11)/t6-/m1/s1

InChIKey

RPKPFOKNXKRFTD-ZCFIWIBFSA-N

LogP

1.9195

Topological Polar Surface Area

38.33 Ų

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

209

Synonyms & References

English

  • (R)-tert-butyl 1-cyanoethylcarbamate
  • EN300-3014037
  • (R)-2-(Boc-amino)propanenitrile
  • DTXSID10420477
  • tert-Butyl 1-cyanoethylcarbamate #
  • SCHEMBL2563210
  • TERT-BUTYL (R)-(1-CYANOETHYL)CARBAMATE
  • A26817
  • t-Butyl (R)-(1-cyanoethyl)carbamate
  • Carbamic acid, [(1R)-1-cyanoethyl]-, 1,1-dimethylethyl ester (9CI)
  • 100927-09-1
  • Carbamic acid, (1-cyanoethyl)-, 1,1-dimethylethyl ester, (R)-
  • tert-butyl N-[(1R)-1-cyanoethyl]carbamate
  • MFCD18633363
  • Carbamic acid,N-[(1R)-1-cyanoethyl]-, 1,1-dimethylethyl ester
  • (R)-(cyano-methyl-methyl)-carbamic acid tert-butyl ester
  • (R)-tert-butyl 1-cyano-ethylcarbamate
  • 2-(boc-amino)-2-methylacetonitrile
  • AC1NUHP5
  • B-1727
  • c1-6(5-9)10-7(11)12-8(2,3)4
  • C8H14N2O2
  • carbamic acid, (1-cyanoethyl)-, 1,1-dimethylethyl ester
  • I14-42231
  • tert-butyl (1-cyanoethyl)carbamate
  • tert-butyl (R)-1-cyanoethylcarbamate
  • (R)-(alpha-Cyano-alpha-methylmethyl)carbamic acid tert-butyl ester
  • N-[(1R)-1-Cyanoethyl]carbamic acid tert-butyl ester
  • tert-butyl N-(1R)-1-cyanoethylcarbamate

MDL Number

MFCD18633363

FAQ

What are the physical and chemical properties of 2-Methyl-2-propanyl [(1R)-1-cyanoethyl]carbamate (CAS: 100927-09-1)?

2-Methyl-2-propanyl [(1R)-1-cyanoethyl]carbamate is a white crystalline solid with a molecular weight of approximately 156.18 g/mol. It has a solubility of about 7.4 g/100 mL in water and is slightly soluble in common organic solvents such as ethanol and acetone. It is mildly reactive and can undergo hydrolysis under basic conditions.

How is 2-Methyl-2-propanyl [(1R)-1-cyanoethyl]carbamate (CAS: 100927-09-1) typically synthesized?

2-Methyl-2-propanyl [(1R)-1-cyanoethyl]carbamate is typically synthesized via a condensation reaction between 2-methylpropanoyl chloride and 1-cyanoethylamine hydrochloride in the presence of a catalytic amount of pyridine. This process yields a pure product with a high selectivity and good yield.

What industries use 2-Methyl-2-propanyl [(1R)-1-cyanoethyl]carbamate (CAS: 100927-09-1)?

2-Methyl-2-propanyl [(1R)-1-cyanoethyl]carbamate is used in pharmaceuticals for synthesizing certain active pharmaceutical ingredients. It also finds applications in the polymer and sensor industries for specific reagent and functional material preparation.

What precautions should be taken when handling 2-Methyl-2-propanyl [(1R)-1-cyanoethyl]carbamate (CAS: 100927-09-1)?

When handling 2-Methyl-2-propanyl [(1R)-1-cyanoethyl]carbamate, it is important to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood to minimize inhalation risks. Spills should be handled with caution, and the Material Safety Data Sheet (MSDS) should be referenced for specific spill cleanup procedures.

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