2-Methyl-2-propanyl (3S)-3-cyano-1-pyrrolidinecarboxylate

Basic Information

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CAS Number

132945-78-9

Molecular Formula

C10H16N2O2

Molecular Weight

185.27 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 Nitriles

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Physical State

White to Yellow Solid

SMILES

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CC(C)(C)OC(=O)N1CCC(C1)C#N

InChI

InChI=1S/C10H16N2O2/c1-10(2,3)14-9(13)12-5-4-8(6-11)7-12/h8H,4-5,7H2,1-3H3/t8-/m1/s1

InChIKey

VDDMCMFPUSCJNA-MRVPVSSYSA-N

LogP

2.2633

Topological Polar Surface Area

29.54 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

272

Safety Information

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GHS Hazard Pictograms

H301

H315

H319

H317

H335

Hazard Statement

H301 Toxic if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H317 May cause an allergic skin reaction
Sensitization, Skin

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

(s)-tert-butyl-3-cyanopyrrolidine-1-carboxylate
B66769
R35ETK6F9K
MFCD03419277
1-N-Boc-3-cyanopyrrolidine, (S)-
(S)-3-Cyano-pyrrolidine-1-carboxylic acid tert-butyl ester
tert-butyl (3S)-3-cyanopyrrolidine-1-carboxylate
AM20080236
CS-W009076
(S)-1-N-Boc-3-cyano-pyrrolidine
AKOS006343475
1-Pyrrolidinecarboxylic acid, 3-cyano-, 1,1-dimethylethyl ester, (S)-
(S)-1-N-BOC-3-CYANOPYRROLIDINE
(S)-1-Boc-3-cyano-pyrrolidine
(S)-1-Boc-3-cyanopyrrolidine
DTXSID50373539
SCHEMBL1968766
(S)-N-BOC-3-CYANOPYRROLIDINE
(S)-1-Boc-3-cyanopyrrolidine, 96%
(S)-tert-butyl 3-cyanopyrrolidine-1-carboxylate
(S)-(+)-1-BOC-3-CYANOPYRROLIDINE
Q-102860
(S)-1-t-butoxycarbonyl-3-cyanopyrrolidine
AC-2239
DS-12034
n-t-boc-3(s)-cyanopyrrolidine
1-pyrrolidinecarboxylic acid, 3-cyano-, 1,1-dimethylethyl ester, (3s)-
EN300-7173848
132945-78-9
1,1-Dimethylethyl (3S)-3-cyano-1-pyrrolidinecarboxylate
AKOS005258717

MDL Number

MFCD03419277

Customs Code

2933990090

FAQ

What is 2-Methyl-2-propanyl (3S)-3-cyano-1-pyrrolidinecarboxylate (CAS: 132945-78-9)?

2-Methyl-2-propanyl (3S)-3-cyano-1-pyrrolidinecarboxylate (CAS: 132945-78-9) is a chemical compound used in pharmaceuticals and research. It consists of a complex molecular structure with a 2-methyl-2-propanyl group attached to a 3S-cyanopyrrolidinecarboxylate moiety.

What are the main uses of 2-Methyl-2-propanyl (3S)-3-cyano-1-pyrrolidinecarboxylate (CAS: 132945-78-9)?

2-Methyl-2-propanyl (3S)-3-cyano-1-pyrrolidinecarboxylate (CAS: 132945-78-9) is primarily used in the synthesis of pharmaceuticals and as a research reagent. It plays a crucial role in the development of new drugs and has applications in the biotechnology and pharmaceutical industries.

Is 2-Methyl-2-propanyl (3S)-3-cyano-1-pyrrolidinecarboxylate (CAS: 132945-78-9) safe?

2-Methyl-2-propanyl (3S)-3-cyano-1-pyrrolidinecarboxylate (CAS: 132945-78-9) is generally considered safe when handled properly. However, it is important to follow safety precautions, including wearing appropriate personal protective equipment and ensuring proper ventilation during use.

How should 2-Methyl-2-propanyl (3S)-3-cyano-1-pyrrolidinecarboxylate (CAS: 132945-78-9) be stored?

2-Methyl-2-propanyl (3S)-3-cyano-1-pyrrolidinecarboxylate (CAS: 132945-78-9) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent degradation and to maintain its purity.