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(3aR,4S,5R,6aS)-4-(tert-Butyldimethylsilyloxy)methyl-5-hydroxy-hexahydro-2H-cyclopenta[b]furan-2-one

HCID 10613232
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
65025-94-7
Standard SMILES
CC(C)(C)[Si](C)(C)OC[C@@H]1[C@H]2CC(=O)O[C@H]2C[C@H]1O
InChIKey
FFONLBDIZPCEQL-KKOKHZNYSA-N
Molecular formula
C14H26O4Si
Average molar mass
286.44 g/mol
Monoisotopic mass
286.16003584

Names & identifiers

Preferred name
(3aR,4S,5R,6aS)-4-(tert-Butyldimethylsilyloxy)methyl-5-hydroxy-hexahydro-2H-cyclopenta[b]furan-2-one
IUPAC
(3aR,4S,5R,6aS)-4-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-hydroxy-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-2-one
English name
(3aR,4S,5R,6aS)-4-(tert-Butyldimethylsilyloxy)methyl-5-hydroxy-hexahydro-2H-cyclopenta[b]furan-2-one
Molecular formula
C14H26O4Si
Molecular weight
286.44

Names & synonyms

65025-94-7(3aR,4S,5R,6aS)-4-(tert-Butyldimethylsilyloxy)methyl-5-hydroxy-hexahydro-2H-cyclopenta[b]furan-2-one(3AR,4S,5R,6aS)-4-(((tert-butyldimethylsilyl)oxy)methyl)-5-hydroxyhexahydro-2H-cyclopenta[b]furan-2-one72777-85-6(3aR,4S,5R,6aS)-4-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-hydroxy-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-2-one(3aR,4S,5R,6aS)-4-[[(tert-Butyldimethylsilyl)oxy]methyl]-5-hydroxyhexahydro-2H-cyclopenta[b]furan-2-onerel-(3AR,4S,5R,6aS)-4-(((tert-Butyldimethylsilyl)oxy)methyl)-5-hydroxyhexahydro-2H-cyclopenta[b]furan-2-one(3aR,4S,5R,6aS)-4-[[[(1,1-Dimethylethyl)dimethylsilyl]oxy]methyl]hexahydro-5-hydroxy-2H-cyclopenta[b]furan-2-one969U9P4EMKSCHEMBL10989953DTXSID70442554MFCD16251273
Show more names
Iloprost Impurity 17(3aR,4S,5R,6aS)-4-(tert-Butyldimethylsilyloxy)methyl-5-hydro...
(3aR,4S,5R,6aS)-4-{[(tert-butyldimethylsilyl)oxy]methyl}-5-hydroxy-hexahydro-2H-cyclopenta[b]furan-2-oneSY365889DB-309852(1S,5R,6S,7R)-6-tert-Butyldimethylsilyloxymethyl-7-hydroxy-2-oxabicyclo[3.3.0]octan-3-one(3aR,4S,5R,6aS)-4-({[tert-Butyldi(methyl)silyl]oxy}methyl)-5-hydroxyhexahydro-2H-cyclopenta[b]furan-2-one2H-Cyclopenta[b]furan-2-one, 4-[[[(1,1-dimethylethyl)dimethylsilyl]oxy]methyl]hexahydro-5-hydroxy-, (3aR,4S,5R,6aS)-2H-Cyclopenta[b]furan-2-one, 4-[[[(1,1-dimethylethyl)dimethylsilyl]oxy]methyl]hexahydro-5-hydroxy-, [3aR-(3aalpha,4alpha,5beta,6aalpha)]-

Properties

Computed structural properties

Topological polar surface area
55.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
19
Formal charge
0
Complexity
361

Physicochemical properties

storage temp.
Refrigerator
solubility
Acetone, Chloroform (Slightly), Dichloromethane, DMSO (Slightly), Ethyl Acetate,
form
Solid
color
White to Off-White
FDA UNII
969 U9P4EMK · 969U9P4EMK

Chemistry & industry

Applications

UsesIntermediate in the preparation of prostaglandin derivatives

Suppliers8 total

凯试(上海)科技有限公司021-50135380 · [email protected]
南京伶亚生物医药科技有限公司18068075658 · [email protected]
北京秦岭医药科技有限公司010-61241352 18901327973 · [email protected]
艾吉析科技(上海)有限公司17717235263 17717235263 · [email protected]
南京安美科技有限公司18936879710 18851749494 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418684 +86-18949823763 · [email protected]

Related reactions

1 records
New reaction record
HRID 371446 reaction equation
HRID 371446As productuspto-grants-1985_07

Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
65025-94-7
PubChem CID
10613232
DTXSID
DTXSID70442554
UNII
969U9P4EMK
Nikkaji
J1.378.894D