CAS 145576-25-6|Acetyl simvastatin

Introduction：Basic information about CAS 145576-25-6|Acetyl simvastatin, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Acetyl simvastatin BiologicalActivity
3. Chemical & Physical Properties
4. Safety Information
5. Synonyms

Common Name	Acetyl simvastatin
CAS Number	145576-25-6	Molecular Weight	460.603
Density	1.1±0.1 g/cm3	Boiling Point	575.2±50.0 °C at 760 mmHg
Molecular Formula	C₂₇H₄₀O₆	Melting Point	/
MSDS	/	Flash Point	243.2±30.2 °C

Names

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
Synonym	More Synonyms

Acetyl simvastatin BiologicalActivity

Description	4-Acetylsimvastatin is an acetylated simvastatin. Simvastatin is a competitive inhibitor of HMG-CoA reductase with a Ki of 0.2 nM[1].
Related Catalog	Research Areas >>OthersSignaling Pathways >>Others >>Others
References	[1]. Brian Morgan, ey al. Methods for Making Simvastatin and Intermediates. US20110059493A1.

Chemical & Physical Properties

Density	1.1±0.1 g/cm3
Boiling Point	575.2±50.0 °C at 760 mmHg
Molecular Formula	C₂₇H₄₀O₆
Molecular Weight	460.603
Flash Point	243.2±30.2 °C
Exact Mass	460.282501
PSA	78.90000
LogP	5.31
Vapour Pressure	0.0±1.6 mmHg at 25°C
Index of Refraction	1.520
InChIKey	OHVWRJDVJRNCPE-BIKFJBPRSA-N
SMILES	CCC(C)(C)C(=O)OC1CC(C)C=C2C=CC(C)C(CCC3CC(OC(C)=O)CC(=O)O3)C21

Safety Information

Hazard Codes	Xi
Risk Phrases	36/37/38
Safety Phrases	26-36

Synonyms

(1S,3R,7S,8S,8aR)-8-{2-[(2R,4R)-4-Acetoxy-6-oxotetrahydro-2H-pyran-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydro-1-naphthalenyl 2,2-dimethylbutanoate

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

4'-Acetyl Simvastatin

Acetyl simvastatin

Simvastatin EP Impurity B

Simvastatin Impurity 2

Recommended......