Sodium (3R,5R)-7-[2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoate

Basic Information

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CAS Number

134523-01-6

Molecular Formula

C33H34FN2NaO5

Molecular Weight

580.6 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

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

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Boiling Point

722.2±60.0 °C at 760 mmHg

Density

1.2±0.1

Flash Point

390.6±32.9 °C

SMILES

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CC(C)C1=C(C(=C(N1CCC(CC(CC(=O)[O-])O)O)C2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4.[Na+]

InChI

InChI=1S/C33H35FN2O5.Na/c1-21(2)31-30(33(41)35-25-11-7-4-8-12-25)29(22-9-5-3-6-10-22)32(23-13-15-24(34)16-14-23)36(31)18-17-26(37)19-27(38)20-28(39)40;/h3-16,21,26-27,37-38H,17-20H2,1-2H3,(H,35,41)(H,39,40);/q;+1/p-1/t26-,27-;/m1./s1

InChIKey

VVRPOCPLIUDBSA-CNZCJKERSA-M

LogP

5.05190

pKa

4.46(at 25℃)

Complexity

829

Synonyms & References

English

134523-01-6
(3R,5R)-Atorvastatin Sodium Salt
EX-A166
sodium;(3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoate
Sodium (3R,5R)-7-(2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl)-3,5-dihydroxyheptanoate
CHEMBL3349878
HY-108257
VVRPOCPLIUDBSA-CNZCJKERSA-M
Atorvastatin sodium- Bio-X
A806792
BA164224
AtorvastatinSodium
Q27276490
Atorvastatin (sodium)
CS-0027825
Sodium (3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-(propan-2-yl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoate
Sodium; 7-[2-(4-fluoro-phenyl)-5-isopropyl-3-phenyl-4-phenylcarbamoyl-pyrrol-1-yl]-3,5-dihydroxy-heptanoate
ATORVASTATIN SODIUM SALT [MI]
DTXSID30635405
UNII-DN43058TIV
DN43058TIV
ATORVASTATIN SODIUM [WHO-DD]
atorvastatin sodium salt
CHEMBL356308
Atorvastatin sodium
BDBM50011213
134523-01-6 (sodium)
MFCD08458204
ATORVASTATIN SODIUM
[R-(R',R')]-2-(4-Fluorophenyl)-3-phenyl-4-[(phenylamino)carbonyl]-5-(1-methylethyl)-1-H-pyrrol-1-(-dihydrogen)heptanoic acid sodium
Atorvastatin sodium salt

MDL Number

MFCD08458204

FAQ

What are the physical and chemical properties of Sodium (3R,5R)-7-[2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoate (CAS: 134523-01-6)?

This compound is a white crystalline solid with a high molecular weight, approximately 736.8 g/mol. It has a low solubility in water but is soluble in polar organic solvents. It is reactive in basic conditions and can undergo hydrolysis. The compound is stable under normal laboratory conditions but should be protected from moisture and light.

How is Sodium (3R,5R)-7-[2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoate (CAS: 134523-01-6) typically synthesized?

This compound is typically synthesized via a multi-step process involving the reaction of a protected pyrrole with an alcohol, followed by deprotection and coupling with a carboxylic acid. Specific reagents like tert-butyldimethylsilyl (TBS) chloride and potassium carbonate are used. The reaction is carried out under mild basic conditions to achieve the desired yield and selectivity.

What industries use Sodium (3R,5R)-7-[2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoate (CAS: 134523-01-6)?

This compound is primarily used in the pharmaceutical industry for drug development. It may also be utilized in the synthesis of advanced materials for sensors and semiconductors due to its unique chemical structure and reactivity.

What precautions should be taken when handling Sodium (3R,5R)-7-[2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoate (CAS: 134523-01-6)?

When handling this compound, wear appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. Work in a well-ventilated area or a fume hood to minimize inhalation risks. Store the compound in a dry, cool place, away from direct sunlight. In case of spill, use appropriate absorbents and consult the Safety Data Sheet (SDS) for detailed instructions.

Related Compounds

N-[(3S)-1-(Dimethylcarbamoyl)-3-pyrrolidinyl]-5-[(Z)-(5-fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide

CAS Number: 1013920-15-4

Molecular Formula: C23H26FN5O3

7-Methylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid structure

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Compound Q&A

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Compound Q&A

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Compound Q&A

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Compound Q&A

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Sodium (3R,5R)-7-[2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoate | CAS No. 134523-01-6

Basic Information

CAS Number

Molecular Formula

Molecular Weight

Chemical Classification

Basic Physical Properties

Boiling Point

Density

Flash Point

Chemical Properties

SMILES

InChI

InChIKey

LogP

pKa

Complexity

Synonyms & References

English

MDL Number

FAQ

What are the physical and chemical properties of Sodium (3R,5R)-7-[2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoate (CAS: 134523-01-6)?

How is Sodium (3R,5R)-7-[2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoate (CAS: 134523-01-6) typically synthesized?

What industries use Sodium (3R,5R)-7-[2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoate (CAS: 134523-01-6)?

What precautions should be taken when handling Sodium (3R,5R)-7-[2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoate (CAS: 134523-01-6)?

Related Compounds

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What is Vinyl(chloromethyl)dimethoxysilane (CAS: 1314981-48-0)?

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