Methyl 3-pyrrolidinecarboxylate

Basic Information

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CAS Number

98548-90-4

Molecular Formula

C6H11NO2

Molecular Weight

129.16 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

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

169.9 ℃ at 760 mmHg

Density

1.055

Flash Point

169.9 °C at 760 mmHg

Refractive Index

1.447

SMILES

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COC(=O)C1CCNC1

InChI

InChI=1S/C6H11NO2/c1-9-6(8)5-2-3-7-4-5/h5,7H,2-4H2,1H3

InChIKey

VVWWZOKQKXPVIV-UHFFFAOYSA-N

LogP

-0.23110000000000003

Topological Polar Surface Area

38.33 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

114

Synonyms & References

English

Methylpyrrolidine-3-carboxylate
3-carbomethoxypyrrolidine
methyl (R)-pyrrolidine-3-carboxylate
SY122122
FT-0687381
3-methoxycarbonylpyrrolidine
SB10233
AKOS000181489
PB24144
Methyl Pyrrolidine-3-carboxylate
VVWWZOKQKXPVIV-UHFFFAOYSA-N
72057-18-2
Pyrrolidine-3-carboxylic acid methyl ester
3-Pyrrolidinecarboxylic acid, methyl ester
SCHEMBL584094
NCGC00322849-01
A25983
EN300-41575
MFCD03788461
BCP26307
PB24127
methyl (+/-)-3-pyrrolidinecarboxylate
DTXSID60399462
SY009240
FT-0647928
AB01319048-02
AM20120399
BS-13042
AC-24325
PB20842
MFCD13191636

MDL Number

MFCD03788461

Customs Code

2933990090

FAQ

What is Methyl 3-pyrrolidinecarboxylate (CAS: 98548-90-4)?

Methyl 3-pyrrolidinecarboxylate (CAS: 98548-90-4) is an organic compound with the chemical formula C6H11NO2. It is a colorless or light yellow liquid with a pungent odor. This compound is commonly used in the synthesis of other chemical intermediates and as a solvent.

What are the main uses of Methyl 3-pyrrolidinecarboxylate (CAS: 98548-90-4)?

Methyl 3-pyrrolidinecarboxylate (CAS: 98548-90-4) is primarily used as a starting material in the synthesis of pharmaceuticals, agrochemicals, and other organic compounds. It is also used as a solvent for certain reactions and as a precursor in the production of polyurethane and other polymers.

Is Methyl 3-pyrrolidinecarboxylate (CAS: 98548-90-4) safe?

Methyl 3-pyrrolidinecarboxylate (CAS: 98548-90-4) is generally considered safe when used under proper handling conditions. However, it is important to follow safety guidelines, including proper ventilation and the use of personal protective equipment. It is mildly irritating to skin and eyes, so care should be taken during handling.

How should Methyl 3-pyrrolidinecarboxylate (CAS: 98548-90-4) be stored?

Methyl 3-pyrrolidinecarboxylate (CAS: 98548-90-4) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a sealed container to prevent moisture absorption. The storage temperature should not exceed 25°C, and it should be protected from freezing. Proper labeling and documentation are also important for safety and regulatory compliance.