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Rosuvastatin intermediate

CAT: 1596-AR-R02072-02Size: 25 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-R02072-02Size:25 Units
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
124655-09-0
Synonyms
(4R-Cis) -6-Hydroxymethyl-2,2-dimethyl-1,3-dioxane-4-acetic acid 1,1-dimethylethyl ester; tert-butyl 2- ((4R,6S) -6- (hydroxymethyl) -2,2-dimethyl-1,3-dioxan-4-yl) acetate; tert-butyl2-[ (4R,6S) -6- (hydroxymethyl) -2,2-dimethyl-1,3-dioxan-4-yl]acetate; (4R-cis) -6- (hydroxymethyl) -2,2-dimethyl-1,3-dioxane-4-acetic acid, 1,1-dimethylethyl ester; D-erythro-Hexonic acid, 2,4-dideoxy-3,5-O- (1-methylethylidene) -, 1,1-dimethylethyl ester; (4R-Cis) -6-Hydroxymethyl-2,2-dimethyl-1,3-dioxane-; Tert-butyl[ (4R,6R) -6-hydroxymethyl-1,3-dioxan-4-yl]acetate; Des Acetyl Rosuvastatin Impurity 34
Molecular Formula
C13H24O5
Molecular Weight
260.33
API Name
Rosuvastatin

Chemical Information

tert-Butyl 2,4-dideoxy-3,5-O-(1-methylethylidene)-D-erythro-hexonate
CAS Number124655-09-0
PubChem CID9816650
IUPAC Nametert-butyl 2-[(4R,6S)-6-(hydroxymethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate
Molecular FormulaC13H24O5
Molecular Weight260.33
XLogP1
Topological Polar Surface Area65
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count18
Formal Charge0
Complexity292
SMILES
CC1(O[C@H](C[C@H](O1)CO)CC(=O)OC(C)(C)C)C
InChI
InChI=1S/C13H24O5/c1-12(2,3)18-11(15)7-9-6-10(8-14)17-13(4,5)16-9/h9-10,14H,6-8H2,1-5H3/t9-,10+/m1/s1
InChIKey
CFRUAOXMCVQMFP-ZJUUUORDSA-N
Chemical Structure
2D Structure
2D structure of tert-Butyl 2,4-dideoxy-3,5-O-(1-methylethylidene)-D-erythro-hexonate
CAS: 124655-09-0
CID: 9816650
Formula: C13H24O5
MW: 260.33
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight260.33
XLogP31
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass260.16237386
Monoisotopic Mass260.16237386
Topological Polar Surface Area65 Ų
Heavy Atom Count18
Formal Charge0
Complexity292
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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