3-Ethyl 1-(2-methyl-2-propanyl) (3S,4R)-4-hydroxy-1,3-pyrrolidinedicarboxylate

Basic Information

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CAS Number

849935-85-9

Molecular Formula

C12H21NO5

Molecular Weight

259.3 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

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

400.051ºC at 760 mmHg

Density

1.222g/cm3

Flash Point

400.051 °C at 760 mmHg

Refractive Index

1.512

SMILES

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CCOC(=O)[C@H]1CN(C[C@@H]1O)C(=O)OC(C)(C)C

InChI

InChI=1S/C12H21NO5/c1-5-17-10(15)8-6-13(7-9(8)14)11(16)18-12(2,3)4/h8-9,14H,5-7H2,1-4H3/t8-,9-/m0/s1

InChIKey

JHBUFXKTKCCCKA-IUCAKERBSA-N

LogP

0.7772999999999994

Topological Polar Surface Area

76.07000000000001 Å²

Hydrogen Bond Donor/Acceptor

1 / 6

Complexity

323

Synonyms & References

English

(3S,4R)-1-tert-Butyl 3-ethyl 4-hydroxypyrrolidine-1,3-dicarboxylate
(4R)-3-ethyl-4-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid
1,3-Pyrrolidinedicarboxylic acid, 4-hydroxy-, 1-(1,1-dimethylethyl) 3-ethyl ester, (3S,4R)-
(3S,4R)-1-(tert-butoxycarbonyl)-3-ethyl-4-hydroxypyrrolidine-3-carboxylic acid
S11-0055
O1-tert-butyl O3-ethyl (3S,4R)-4-hydroxypyrrolidine-1,3-dicarboxylate

MDL Number

MFCD12756145

FAQ

What is 3-Ethyl 1-(2-methyl-2-propanyl) (3S,4R)-4-hydroxy-1,3-pyrrolidinedicarboxylate (CAS: 849935-85-9)?

3-Ethyl 1-(2-methyl-2-propanyl) (3S,4R)-4-hydroxy-1,3-pyrrolidinedicarboxylate is a chemical compound with the CAS number 849935-85-9. It is a white or off-white solid with a characteristic odor. This compound has a molecular formula of C12H20O5 and is used in various applications such as pharmaceuticals and research.

What are the main uses of 3-Ethyl 1-(2-methyl-2-propanyl) (3S,4R)-4-hydroxy-1,3-pyrrolidinedicarboxylate (CAS: 849935-85-9)?

3-Ethyl 1-(2-methyl-2-propanyl) (3S,4R)-4-hydroxy-1,3-pyrrolidinedicarboxylate is primarily used in the pharmaceutical industry as a key intermediate for synthesizing other compounds. It is also utilized in research for its unique chemical properties.

Is 3-Ethyl 1-(2-methyl-2-propanyl) (3S,4R)-4-hydroxy-1,3-pyrrolidinedicarboxylate (CAS: 849935-85-9) safe?

3-Ethyl 1-(2-methyl-2-propanyl) (3S,4R)-4-hydroxy-1,3-pyrrolidinedicarboxylate is considered safe when handled properly. However, it is important to follow all safety precautions, including wearing appropriate personal protective equipment and storing it in a cool, dry place away from direct sunlight.

How should 3-Ethyl 1-(2-methyl-2-propanyl) (3S,4R)-4-hydroxy-1,3-pyrrolidinedicarboxylate (CAS: 849935-85-9) be stored?

3-Ethyl 1-(2-methyl-2-propanyl) (3S,4R)-4-hydroxy-1,3-pyrrolidinedicarboxylate should be stored in a cool, dry, and well-ventilated environment. It should be kept away from heat sources, direct sunlight, and other incompatible materials. Proper storage containers, such as tightly sealed glass or metal containers, should be used to prevent contamination and degradation.