2-Methyl-2-propanyl N-[(3S)-3-pyrrolidinyl]glycinate

Basic Information

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CAS Number

169750-01-0

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 Sticky Oil to Solid

Boiling Point

268 ºC

Flash Point

116 ºC

Refractive Index

1.48

SMILES

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

InChI

InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)7-12-8-4-5-11-6-8/h8,11-12H,4-7H2,1-3H3/t8-/m0/s1

InChIKey

AYEXDBHPMVPDER-QMMMGPOBSA-N

LogP

1.2151999999999996

Topological Polar Surface Area

41.57000000000001 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

H332 Harmful if inhaled
Acute toxicity, inhalation

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

Synonyms & References

English

AS-83491
(S)-3-(N-Boc-N-methylamino)pyrrolidine
SCHEMBL181909
AM90327
Q-102165
(S)-3-(N-Bocmethylamino)pyrrolidine
(S)-3-(N-Boc-Methylamino)pyrrolidine
EN300-7184073
CS-W003552
tert-butyl N-methyl-N-[(3S)-pyrrolidin-3-yl]carbamate
(S)-TERT-BUTYLMETHYL(PYRROLIDIN-3-YL)CARBAMATE
(S)-TERT-BUTYL METHYL(PYRROLIDIN-3-YL)CARBAMATE
(S)-3-[N-(Tert-Butoxycarbonyl)-N-Methylamino]Pyrrolidine
Carbamic acid, methyl(3S)-3-pyrrolidinyl-, 1,1-dimethylethyl ester
169750-01-0
AKOS005259262
J-502440
(S)-3-[N-(tert-butoxycarbonyl)-N-methyl-amino]pyrrolidine
DTXSID10428251
(S)-METHYL-PYRROLIDIN-3-YL-CARBAMIC ACID TERT-BUTYL ESTER
MFCD08703388
tert-Butyl methyl[(3S)-pyrrolidin-3-yl]carbamate
Methyl-(S)-pyrrolidin-3-yl-carbamic acid tert-butyl ester
XYKYUXYNQDXZTD-QMMMGPOBSA-N
TS-02841
(S)-tert-Butyl methyl(pyrrolidin-3-yl)carbamate
(S)-3-(N-Boc-methylamino)pyrrolidine
(S)-3-(N-BOC-N-METHYLAMINO)PYRROLIDINE
Carbamic acid,N-methyl-N-(3S)-3-pyrrolidinyl-, 1,1-dimethylethyl ester
tert-butyl (S)-methyl(pyrrolidin-3-yl)carbamate
tert-butyl methyl(s)-pyrrolidin-3-ylcarbamate

MDL Number

MFCD08703388

Customs Code

2933990090

FAQ

What are the physical and chemical properties of 2-Methyl-2-propanyl N-[(3S)-3-pyrrolidinyl]glycinate (CAS: 169750-01-0)?

2-Methyl-2-propanyl N-[(3S)-3-pyrrolidinyl]glycinate is a white crystalline solid with a molecular weight of approximately 208.29 g/mol. It is sparingly soluble in water and moderately soluble in common organic solvents like ethanol and acetone. The compound is generally stable but may react with strong acids or bases. It is not flammable but should be stored in a cool, dry place away from direct sunlight.

How is 2-Methyl-2-propanyl N-[(3S)-3-pyrrolidinyl]glycinate (CAS: 169750-01-0) typically synthesized?

2-Methyl-2-propanyl N-[(3S)-3-pyrrolidinyl]glycinate is typically synthesized via a multistep process involving the reaction of 2-methyl-2-propanol with 3-pyrrolidinecarboxylic acid. Commonly, this involves a condensation reaction followed by a ring closure step. The reaction is catalyzed by organic bases and proceeds with good yield and high selectivity.

What industries use 2-Methyl-2-propanyl N-[(3S)-3-pyrrolidinyl]glycinate (CAS: 169750-01-0)?

2-Methyl-2-propanyl N-[(3S)-3-pyrrolidinyl]glycinate is primarily used in pharmaceuticals for the synthesis of certain drug intermediates. It can also be found in the polymer industry as a monomer or in the production of sensors and semiconductors due to its unique chemical properties.

What precautions should be taken when handling 2-Methyl-2-propanyl N-[(3S)-3-pyrrolidinyl]glycinate (CAS: 169750-01-0)?

When handling 2-Methyl-2-propanyl N-[(3S)-3-pyrrolidinyl]glycinate, it is important to wear appropriate personal protective equipment (PPE), including gloves and goggles, and to work in a well-ventilated area or fume hood. The substance should be stored in a cool, dry place away from direct sunlight. In case of spill, it should be cleaned up carefully following standard laboratory procedures and handled according to the Safety Data Sheet (SDS).