2-Methyl-2-propanyl (2S)-2-(hydroxymethyl)-1-pyrrolidinecarboxylate

Basic Information

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CAS Number

69610-40-8

Molecular Formula

C10H19NO3

Molecular Weight

201.27 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 Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Physical State

White to Yellow Solid

Melting Point

60.0 to 64.0 deg-C

Boiling Point

150°C/4mmHg

Density

1.0948 (rough estimate)

Flash Point

128.9℃

Refractive Index

-55 ° (C=5, MeOH)

Specific Rotation

-52 º (c=1, CHCl3)

SMILES

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CC(C)(C)OC(=O)N1CCCC1CO

InChI

InChI=1S/C10H19NO3/c1-10(2,3)14-9(13)11-6-4-5-8(11)7-12/h8,12H,4-7H2,1-3H3/t8-/m0/s1

InChIKey

BFFLLBPMZCIGRM-QMMMGPOBSA-N

LogP

1.3781999999999999

Topological Polar Surface Area

49.769999999999996 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

210

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

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

N-t-butoxycarbonyl-L-prolinol
(S)-1-BOC-PYRROLIDIN-2-YL-METHANOL
(S)-1-(tert-Butoxycarbonyl)-2-pyrrolidinemethanol
(S)-1-tert-butoxycarbonyl-2-pyrrolidinemethanol
AS-14671
B3077
Z1269217618
69610-40-8
EN300-153848
(2S)-1-tert-butoxycarbonyl-2-pyrrolidinemethanol
(S)-(-)-N-BOC-PROLINOL
(S)-(-)-1-Boc-2-pyrrolidinemethanol
MFCD00066232
N-Boc-L-prolinol, 98%
NS00120366
N-BOC-(S)-2-Hydroxymethylpyrrolidine
N-tert-butoxycarbonyl-(2S)-2-pyrrolidinemethanol
N-t-Butoxycarbonyl-2(S)-hydroxymethylpyrrolidine
N-tert-butoxycarbonyl prolinol
(S)-1-t-Butoxycarbonyl-2-pyrrolidinemethanol
(S)-2-(hydroxymethyl)-1-pyrrolidinecarboxylic acid, 1,1-dimethylethyl ester
AKOS005259749
CHEMBL4764441
2-(S)-hydroxymethyl-pyrrolidine-1-carboxylic acid tert-butyl ester
(S)-tert-butyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate
AKOS000282946
BFFLLBPMZCIGRM-QMMMGPOBSA-N
AM20100654
N-(tert.-butyloxycarbonyl)-L-prolinol
Boc-L-Prolinol
CS-W019895

MDL Number

MFCD00066232

Customs Code

2933990090

FAQ

What is 2-Methyl-2-propanyl (2S)-2-(hydroxymethyl)-1-pyrrolidinecarboxylate (CAS: 69610-40-8)?

2-Methyl-2-propanyl (2S)-2-(hydroxymethyl)-1-pyrrolidinecarboxylate (CAS: 69610-40-8) is an organic compound containing a pyrrolidine ring substituted with a carboxylate group and a hydroxymethyl group. It is a chiral molecule with the (2S) configuration, making it valuable in pharmaceutical and chemical research. The compound is typically used as an intermediate in the synthesis of various bioactive molecules.

What are the main uses of 2-Methyl-2-propanyl (2S)-2-(hydroxymethyl)-1-pyrrolidinecarboxylate (CAS: 69610-40-8)?

This compound is primarily used in pharmaceutical research for the development of drugs targeting specific biological pathways. It also serves as an intermediate in the synthesis of agrochemicals and specialty chemicals. Its structural features make it applicable in organic synthesis and for creating derivatives with enhanced functional properties.

Is 2-Methyl-2-propanyl (2S)-2-(hydroxymethyl)-1-pyrrolidinecarboxylate (CAS: 69610-40-8) safe?

The safety of 2-Methyl-2-propanyl (2S)-2-(hydroxymethyl)-1-pyrrolidinecarboxylate (CAS: 69610-40-8) depends on its application and exposure conditions. As a chemical intermediate, it requires careful handling to avoid skin contact and inhalation. Protective measures such as gloves, goggles, and proper ventilation are recommended. Safety data sheets (SDS) should be consulted for full details on its hazards and safe usage.

How should 2-Methyl-2-propanyl (2S)-2-(hydroxymethyl)-1-pyrrolidinecarboxylate (CAS: 69610-40-8) be stored?

This compound should be stored in a cool, dry, and dark place, ideally at temperatures below 25°C. It is sensitive to moisture and light, so it should be kept in a sealed container with a desiccant. Storage in a well-ventilated area is also recommended to prevent any potential degradation or contamination.