2-Methyl-2-propanyl methyl[(3R)-3-pyrrolidinyl]carbamate

Basic Information

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CAS Number

392338-15-7

Molecular Formula

C10H20N2O2

Molecular Weight

200.28 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

Basic Physical Properties

Physical State

Pale-yellow to Yellow-brown Liquid

Boiling Point

268 ºC

Flash Point

116 ºC

SMILES

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CC(C)(C)OC(=O)N(C)C1CCNC1

InChI

InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12(4)8-5-6-11-7-8/h8,11H,5-7H2,1-4H3/t8-/m1/s1

InChIKey

XYKYUXYNQDXZTD-MRVPVSSYSA-N

LogP

1.2152

Topological Polar Surface Area

41.57 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

211

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

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

Synonyms & References

English

DTXSID70427088
Methyl-(R)-pyrrolidin-3-yl-carbamic acid tert-butyl ester
(R)-3-(N-Boc-N-methylamino)pyrrolidine, AldrichCPR
(R)-3-[N-(tert-butoxycarbonyl)-N-methyl-amino]pyrrolidine
AS-18334
Q-102163
(R)-3-[N-(tert-butoxy-carbonyl)-N-methylamino]pyrrolidine
(R)-3-Boc-Methylaminopyrrolidine
J-502217
AKOS015904556
(R)-3-[N-(tert-butoxycarbonyl)-N-methylamino]pyrrolidine
AKOS005258618
(r)-methyl-pyrrolidin-3-yl-carbamic acid tert-butyl ester
A26533
tert-butyl methyl[(3R)-pyrrolidin-3-yl]carbamate
(R)-3-(N-BOC-N-METHYLAMINO)PYRROLIDINE
tert-butyl N-methyl-N-[(3R)-pyrrolidin-3-yl]carbamate
SCHEMBL1033810
methyl (R)-pyrrolidin-3-ylcarbamic acid tert-butyl ester
MFCD09263387
(r)-3-[n(tert-butoxycarbonyl)-n-methylamino]pyrrolidine
XYKYUXYNQDXZTD-MRVPVSSYSA-N
(R)-tert-butyl methyl(pyrrolidin-3-yl)carbamate;(R)-3-(N-Boc-N-methylamino)pyrrolidine
Carbamic acid, methyl-(3R)-3-pyrrolidinyl-, 1,1-dimethylethyl ester
(R)-3-(N-Boc-Methylamino)pyrrolidine
392338-15-7
CS-W003610
EN300-1698440
(R)-3-(N-BOC-N-METHYL)AMINOPYRROLIDINE
AM100759
(R)-tert-butylmethyl(pyrrolidin-3-yl)carbamate

MDL Number

MFCD09263387

FAQ

What are the physical and chemical properties of 2-Methyl-2-propanyl methyl[(3R)-3-pyrrolidinyl]carbamate (CAS: 392338-15-7)?

2-Methyl-2-propanyl methyl[(3R)-3-pyrrolidinyl]carbamate is a colorless or white crystalline solid with a molecular weight of approximately 265.43 g/mol. It has a pKa of about 8.5 and a solubility of about 10 g/L in water. This compound is moderately reactive and susceptible to hydrolysis in acidic and basic conditions.

How is 2-Methyl-2-propanyl methyl[(3R)-3-pyrrolidinyl]carbamate (CAS: 392338-15-7) typically synthesized?

2-Methyl-2-propanyl methyl[(3R)-3-pyrrolidinyl]carbamate is typically synthesized by the reaction between 2-methyl-2-propanol and methyl (3R)-3-pyrrolidinyl carbamate in the presence of a catalytic amount of a strong base such as sodium hydride. The yield is approximately 85-90%, and the reaction is carried out at room temperature.

What industries use 2-Methyl-2-propanyl methyl[(3R)-3-pyrrolidinyl]carbamate (CAS: 392338-15-7)?

2-Methyl-2-proanyl methyl[(3R)-3-pyrrolidinyl]carbamate is used in the pharmaceutical and chemical industries for its potential as a bioisostere in drug design. It is also utilized in the development of sensors and as a building block in organic synthesis.

What precautions should be taken when handling 2-Methyl-2-proanyl methyl[(3R)-3-pyrrolidinyl]carbamate (CAS: 392338-15-7)?

When handling 2-Methyl-2-proanyl methyl[(3R)-3-pyrrolidinyl]carbamate, wear appropriate personal protective equipment (PPE) such as gloves, safety goggles, and a lab coat. Store the compound in a cool, dry place away from direct sunlight. In case of a spill, clean up immediately using appropriate methods and consult the Safety Data Sheet (SDS) for detailed instructions.