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Atorvastatin Calcium Trihydrate

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Atorvastatin Calcium Trihydrate / CAS : 344423-98-9

Appearance White powder UN 0.0
HS 29332900 DG Class 0.0
Synonyms Atorvastatin Hemicalcium Trihydrate; Calcium (3R,5R)-7-(2-(4-Fluorophenyl)-5-Isopropyl-3-Phenyl-4-(Phenylcarbamoyl)-1H-Pyrrol-1-yl)-3,5-Dihydroxyheptanoate Trihydrate; Atorvastatin Calcium salt Trihydrate; Atorvastatin Calcium
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Properties

Summary

Formula
C66H74CaF2N4O13
Molecular Mass
1209.3875664
Exact Mass
1208.48000
PSA
256.93000
Logp
9.91090
IUPAC
calcium;(3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoate;trihydrate
SMILES
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.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.O.O.O.[Ca+2]

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Circulatory System Drugs

Chemical and Physical Properties

Appearance
White powder

Export information

HS Code
29332900
Export Rebate
13%
UN No.
0.0
DG-Class
0.0
Risk Code
61-36
Safety Label
T

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