4′-Acetyl Simvastatin - ≥95% , CAS No.145576-25-6

CAS: 145576-25-6 Cat. No.: A347288 Fórmula: C27H40O6 Peso molecular: 460.6 Número CE: 641-866-5 PubChem CID: 11812557
Disponível para encomenda
GRADE & PURITY ≥95%
Synonyms
ACETYL SIMVASTATIN [USP-RS] | Butanoic acid, 2,2-dimethyl-, (1S,3R,7S,8S,8aR)-8-[2-[(2R,4R)-4-(acetyloxy)tetrahydro-6-oxo-2H-pyran-2-yl]ethyl]-1,2,3,7,8,8a-hexahydro-3,7-dimethyl-1-naphthalenyl ester | SIMVASTATIN IMPURITY B [EP IMPURITY] | 171OXS3HEK | S
Storage
Store at -20°C,Argon charged
Shipped In
Ice chest + Ice pads
★
Size
Alemanha (EU)
USA*
Price
Qty
5mg
A347288-5mg
Sob encomenda · 8–12 semanas
282,80€
10mg
A347288-10mg
—
2 Em stock

434,65€

507,54€
Gravar 72,89 € (14.36%)
25mg
A347288-25mg
—
2 Em stock

868,52€

1014,30€
Gravar 145,78 € (14.37%)
50mg
A347288-50mg
—
2 Em stock

1379,62€

1609,57€
Gravar 229,95 € (14.29%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -20°C,Argon charged Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Visão geral

4′-Acetyl Simvastatin is a simvastatin impurity.

Specifications

Sinónimos
ACETYL SIMVASTATIN [USP-RS] | Butanoic acid, 2,2-dimethyl-, (1S,3R,7S,8S,8aR)-8-[2-[(2R,4R)-4-(acetyloxy)tetrahydro-6-oxo-2H-pyran-2-yl]ethyl]-1,2,3,7,8,8a-hexahydro-3,7-dimethyl-1-naphthalenyl ester | SIMVASTATIN IMPURITY B [EP IMPURITY] | 171OXS3HEK | S
Especificações e pureza
≥95%
Condições de armazenamento de armazenamento
Store at -20°C,Argon charged
Enviado em
Ice chest + Ice pads
Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.
Tipo de ação
INHIBITOR
Pureza
≥95%
Nomes e identificadores
Pubchem Sid504766757
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504766757
Sorrisos canónicosCCC(C)(C)C(=O)OC1CC(C=C2C1C(C(C=C2)C)CCC3CC(CC(=O)O3)OC(=O)C)C
IUPAC Name[(1S,3R,7S,8S,8aR)-8-[2-[(2R,4R)-4-acetyloxy-6-oxooxan-2-yl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2,2-dimethylbutanoate
InChIKeyOHVWRJDVJRNCPE-BIKFJBPRSA-N
INCHI1S/C27H40O6/c1-7-27(5,6)26(30)33-23-13-16(2)12-19-9-8-17(3)22(25(19)23)11-10-20-14-21(31-18(4)28)15-24(29)32-20/h8-9,12,16-17,20-23,25H,7,10-11,13-15H2,1-6H3/t16-,17-,20+,21+,22-,23-,25-/m0/s1
SMILES isoméricas CCC(C)(C)C(=O)O[C@H]1C[C@H](C=C2[C@H]1[C@H]([C@H](C=C2)C)CC[C@@H]3C[C@H](CC(=O)O3)OC(=O)C)C
PubChem CID 11812557
Peso molecular 460.6

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganic acids and derivatives
ClasseCarboxylic acids and derivatives
SubclassTricarboxylic acids and derivatives
Intermediate Tree Nodes Not available
Direct ParentTricarboxylic acids and derivatives
Alternative Parents Fatty acid esters  Delta valerolactones  Oxanes  Carboxylic acid esters  Oxacyclic compounds  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic heteropolycyclic compounds
Substituents Tricarboxylic acid or derivatives - Delta valerolactone - Fatty acid ester - Delta_valerolactone - Oxane - Fatty acyl - Lactone - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Aliphatic heteropolycyclic compound
DescriçãoThis compound belongs to the class of organic compounds known as tricarboxylic acids and derivatives. These are carboxylic acids containing exactly three carboxyl groups.
External Descriptors Not available
Estrutura 3D
Modelo de Estrutura Química Interativa





Certificados(CoA,COO,BSE/TSE e Mapa de Análise)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

7 results found

Lot NumberCertificate TypeDataItem
A2307204Certificate of AnalysisSep 06, 2022 A347288
A2307205Certificate of AnalysisSep 06, 2022 A347288
A2307206Certificate of AnalysisSep 06, 2022 A347288
A2307214Certificate of AnalysisSep 06, 2022 A347288
A2307216Certificate of AnalysisSep 06, 2022 A347288
A2307224Certificate of AnalysisSep 06, 2022 A347288
C2524014Certificate of AnalysisSep 06, 2022 A347288
Propriedades químicas e físicas
SolubilidadeAcetonitrile (Slightly), Chloroform (Slightly), Ethyl Acetate (Slightly), Methan
SensibilidadeHygroscopic
Peso molecular460.600 g/mol
XLogP35.300
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count9
Exact Mass460.282 Da
Monoisotopic Mass460.282 Da
Topological Polar Surface Area78.900 Ų
Heavy Atom Count33
Formal Charge0
Complexity809.000
Isotope Atom Count0
Defined Atom Stereocenter Count7
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Calculadoras de soluções
Revisões

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