2-Methyl-2-propanyl [(3S)-3-pyrrolidinylmethyl]carbamate

Basic Information

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CAS Number

173340-26-6

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

Boiling Point

303.9°C at 760 mmHg

SMILES

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CC(C)(C)OC(=O)NCC1CCNC1

InChI

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

InChIKey

WIEJVMZWPIUWHO-QMMMGPOBSA-N

LogP

1.1205999999999998

Topological Polar Surface Area

50.36 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

199

Safety Information

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Hazard Statement

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

MFCD06796616
(S)-3-N-Boc-aminomethylpyrrolidine
CARBAMIC ACID, N-[(3S)-3-PYRROLIDINYLMETHYL]-, 1,1-DIMETHYLETHYL ESTER
Carbamic acid, (3-pyrrolidinylmethyl)-, 1,1-dimethylethyl ester, (S)- (9CI)
173340-26-6
1,1-dimethylethyl [(3S)-3-pyrrolidinylmethyl]carbamate
AC-7644
CS-W004177
SCHEMBL718404
DTXSID40364037
(s)-tert-butyl pyrrolidin-3-ylmethylcarbamate
tert-butyl (3S)-pyrrolidin-3-ylmethylcarbamate
Carbamic acid,(3-pyrrolidinylmethyl)-,1,1-dimethylethyl ester,(S)-(9ci)
tert-butyl N-[[(3S)-pyrrolidin-3-yl]methyl]carbamate
AKOS005258597
(s)-3-boc-aminomethylpyrrolidine
(S)-1-pyrrolidin-3-ylmethyl-carbamic acid tert-butyl ester
tert-Butyl {[(3S)-pyrrolidin-3-yl]methyl}carbamate
AM20090032
tert-butyl N-[(3S)-pyrrolidin-3-ylmethyl]carbamate
A3829
SCHEMBL22830512
CARBAMIC ACID, (3-PYRROLIDINYLMETHYL)-, 1,1-DIMETHYLETHYL ESTER, (S)-
(S)-Pyrrolidin-3-ylmethyl-carbamic acid tert-butyl ester
(5)-tert-Butyl pyrrolidin-3-ylmethylcarbamate
(s)-3-n-boc-aminomethyl pyrrolidine
WIEJVMZWPIUWHO-QMMMGPOBSA-N
EN300-88135
tert-butyl ((S)-pyrrolidin-3-yl)MethylcarbaMate
(S)-tert-Butylpyrrolidin-3-ylmethylcarbamate
(S)-tert-Butyl (pyrrolidin-3-ylmethyl)carbamate

MDL Number

MFCD06796616

Customs Code

2933990090

FAQ

What are the physical and chemical properties of 2-Methyl-2-propanyl [(3S)-3-pyrrolidinylmethyl]carbamate (CAS: 173340-26-6)?

2-Methyl-2-propanyl [(3S)-3-pyrrolidinylmethyl]carbamate is a colorless to white crystalline solid with a molecular weight of approximately 249.3 g/mol. It has a high solubility in organic solvents such as ethanol and acetone. Chemically, it is reactive towards nucleophiles and can undergo hydrolysis. It also shows good solubility in water up to 1.25 g/L at 20°C.

How is 2-Methyl-2-proanyl [(3S)-3-pyrrolidinylmethyl]carbamate (CAS: 173340-26-6) typically synthesized?

2-Methyl-2-proanyl [(3S)-3-pyrrolidinylmethyl]carbamate is typically synthesized via the reaction of 2-methylpropyl isocyanate with (3S)-3-pyrrolidinylmethylamine. The synthesis involves the use of a mild base as a catalyst, and the product can be isolated by recrystallization from an appropriate solvent.

What industries use 2-Methyl-2-proanyl [(3S)-3-pyrrolidinylmethyl]carbamate (CAS: 173340-26-6)?

2-Methyl-2-proanyl [(3S)-3-pyrrolidinylmethyl]carbamate is used in the pharmaceutical industry for the synthesis of various drugs. It also finds applications in the polymer industry for the modification of polymers, and in the semiconductor industry for the production of chemical sensors and other electronic devices.

What precautions should be taken when handling 2-Methyl-2-proanyl [(3S)-3-pyrrolidinylmethyl]carbamate (CAS: 173340-26-6)?

When handling 2-Methyl-2-proanyl [(3S)-3-pyrrolidinylmethyl]carbamate, it is essential to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. It should be stored in a cool, well-ventilated area away from direct sunlight and heat sources. In case of spill, it should be contained and disposed of according to the Material Safety Data Sheet (MSDS).