trans-4-Hydroxy-1-(4-nitrobenzyloxycarbonyl)-L-proline

Basic Information

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CAS Number

96034-57-0

Molecular Formula

C13H14N2O7

Molecular Weight

310.26 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

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

182-183 ºC

Boiling Point

578.308 °C at 760 mmHg

Density

1.557

Flash Point

303.55 °C

SMILES

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C1C(CN(C1C(=O)O)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C13H14N2O7/c16-10-5-11(12(17)18)14(6-10)13(19)22-7-8-1-3-9(4-2-8)15(20)21/h1-4,10-11,16H,5-7H2,(H,17,18)/t10-,11+/m1/s1

InChIKey

JMJMJDNHVXYAOC-MNOVXSKESA-N

LogP

1.21230

Complexity

442

Synonyms & References

English

1,2-Pyrrolidinedicarboxylicacid, 4-hydroxy-, 1-[(4-nitrophenyl)methyl] ester, (2S,4R)-
(2S,4R)-4-Hydroxy-1,2-pyrrolidinedicarboxylic Acid 1-(4-Nitrobenzyl) Ester
(2S,4R)-4-hydroxy-1-[(4-nitrophenyl)methoxycarbonyl]pyrrolidine-2-carboxylic acid
1,2-Pyrrolidinedicarboxylic acid, 4-hydroxy-, 1-[(4-nitrophenyl)methyl] ester, (2S-trans)- (ZCI)
1-[(4-Nitrophenyl)methyl] (2S,4R)-4-hydroxy-1,2-pyrrolidinedicarboxylate (ACI)
(2S,4R)-1-(4-Nitrobenzyloxycarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid
(2S,4R)-1-(p-Nitrobenzyloxycarbonyl)-4-hydroxyproline
trans-4-Hydroxy-1-(4-nitrobenzyloxycarbonyl)-L-proline
L
(2S,4R)-4-hydroxy-1-(4-nitrobenzyloxycarbonyl)proline
trans-4-hydroxy-1-(4-nitro-benzyloxycarbonyl)-L-proline
JMJMJDNHVXYAOC-MNOVXSKESA-N
96034-57-0
MFCD16294320
(2S,4R)-4-hydroxy-1-[(4-nitrophenyl)methoxycarbonyl]pyrrolidine-2-carboxylic Acid
trans-1-p-nitrobenzyloxycarbonyl-4-hydroxy-L-proline
DTXSID60441879
(2S,4R)-1-((4-Nitrobenzyloxy)carbonyl)-4-hydroxypyrrolidine-2-carboxylic acid
AKOS025402689
BS-50279
(4R)-4-Hydroxy-1-{[(4-nitrophenyl)methoxy]carbonyl}-L-proline
1,2-Pyrrolidinedicarboxylic acid, 4-hydroxy-, 1-[(4-nitrophenyl)methyl]ester, (2S,4R)-
(2S,4R)-4-Hydroxy-1-(((4-nitrobenzyl)oxy)carbonyl)pyrrolidine-2-carboxylic acid
(2S-trans)-4-Hydroxy-1,2-pyrrolidinedicarboxylic Acid 1-[(4-Nitrophenyl)methyl] Ester; (2S,4R)-1-(p-Nitrobenzyloxycarbonyl)-4-hydroxyproline; trans-4-Hydroxy-1-(4-nitrobenzyloxycarbonyl)-L-proline;
trans-1-(p-nitrobenzyloxycarbonyl)-4-hydroxy-L-proline
(2S,4R)-4-HYDROXY-1-{[(4-NITROPHENYL)METHOXY]CARBONYL}PYRROLIDINE-2-CARBOXYLIC ACID
N-p-nitrobenzyloxycarbonyl-L-hydroxyproline
TRANS-4-HYDROXY-1-(4-NITROBENZYLOXYCARBONYL)-L-PROLINE
SCHEMBL5391199
(2S,4R)-4-Hydroxy-1-(4-nitrobenzyloxycarbonyl)pyrrolidine-2-carboxylic acid
(2S-trans)-4-Hydroxy-1,2-pyrrolidinedicarboxylic Acid 1-[(4-Nitrophenyl)methyl] Ester

MDL Number

MFCD16294320

Customs Code

2933990090

FAQ

What are the physical and chemical properties of trans-4-Hydroxy-1-(4-nitrobenzyloxycarbonyl)-L-proline (CAS: 96034-57-0)?

Trans-4-Hydroxy-1-(4-nitrobenzyloxycarbonyl)-L-proline (CAS: 96034-57-0) is a crystalline compound with a molecular weight of approximately 331.07 g/mol. It has a low solubility in water but is more soluble in organic solvents such as ethanol and acetone. It is moderately reactive, particularly under basic conditions. The compound can form stable esters and amides, and it is used in various synthetic transformations.

How is trans-4-Hydroxy-1-(4-nitrobenzyloxycarbonyl)-L-proline (CAS: 96034-57-0) typically synthesized?

Trans-4-Hydroxy-1-(4-nitrobenzyloxycarbonyl)-L-proline (CAS: 96034-57-0) is typically synthesized via a multi-step process involving the protection of L-proline with a benzyloxycarbonyl group, followed by the introduction of the hydroxy group and nitration of the aromatic ring. The synthesis often requires the use of reagents like p-nitrobenzyl chloride, hydroxylation catalysts, and nitration agents like nitric acid. The yield and selectivity can be optimized using appropriate reaction conditions and purification techniques.

What industries use trans-4-Hydroxy-1-(4-nitrobenzyloxycarbonyl)-L-proline (CAS: 96034-57-0)?

Trans-4-Hydroxy-1-(4-nitrobenzyloxycarbonyl)-L-proline (CAS: 96034-57-0) is primarily used in the pharmaceutical and chemical industries. It serves as a precursor in the synthesis of complex organic molecules, particularly in the development of pharmaceuticals. Its use in polymer synthesis and as a chiral auxiliary in asymmetric synthesis is also reported, making it valuable in the development of new materials and sensors.

What precautions should be taken when handling trans-4-Hydroxy-1-(4-nitrobenzyloxycarbonyl)-L-proline (CAS: 96034-57-0)?

When handling trans-4-Hydroxy-1-(4-nitrobenzyloxycarbonyl)-L-proline (CAS: 96034-57-0), it is essential to use personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood to minimize exposure to dust and vapors. Spills should be handled carefully, and appropriate cleanup procedures should be followed. Always consult the Safety Data Sheet (SDS) for detailed information on handling and disposal.