5,6-O-Isopropylidene-L-gulono-1,4-lactone , CAS No.94697-68-4

CAS: 94697-68-4 Cat. No.: O350754 Peso molecular: 218.21
Disponible para pedir
Synonyms
DTXSID20662043 | (3S,4R,5S)-5-[(4S)-2,2-DIMETHYL-1,3-DIOXOLAN-4-YL]-3,4-DIHYDROXYOXOLAN-2-ONE | 5,6-O-Isopropylidene-L-gulonic acid gamma-lactone, >=99.0% (sum of enantiomers, TLC) | AKOS007930486 | SCHEMBL1738813 | 5,6-O-Isopropylidene-L-gulono-1,4-lacto
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
1g
O350754-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
307,90US$
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Why this grade

for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

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

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Quality documents

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

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Literature proof

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

Descripción general

5,6-O-Isopropylidene-L-gulono-1,4-lactone is a useful starting material for the synthesis of an array of compounds modified in the 2 and 3 positions.

Specifications

Sinónimos
DTXSID20662043 | (3S, 4R, 5S)-5-[(4S)-2, 2-DIMETHYL-1, 3-DIOXOLAN-4-YL]-3, 4-DIHYDROXYOXOLAN-2-ONE | 5, 6-O-Isopropylidene-L-gulonic acid gamma-lactone, >=99.0% (sum of enantiomers, TLC) | AKOS007930486 | SCHEMBL1738813 | 5, 6-O-Isopropylidene-L-gulono-1, 4-lacto
Condiciones de almacenamiento de almacenamiento
Store at -20°C
Enviado en
Ice chest + Ice pads
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Nombres e identificadores
Sonrisas canónicasCC1(OCC(O1)C2C(C(C(=O)O2)O)O)C
IUPAC Name(3S,4R,5S)-5-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-3,4-dihydroxyoxolan-2-one
InChIKeyJNTPPVKRHGNFKM-BNHYGAARSA-N
INCHI1S/C9H14O6/c1-9(2)13-3-4(15-9)7-5(10)6(11)8(12)14-7/h4-7,10-11H,3H2,1-2H3/t4-,5+,6-,7+/m0/s1
Isómeros SMILES CC1(OC[C@H](O1)[C@@H]2[C@@H]([C@@H](C(=O)O2)O)O)C
Peso molecular 218.21
Reaxy-Rn 39830094
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=39830094&ln=

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 oxygen compounds
ClaseOrganooxygen compounds
SubclassEthers
Intermediate Tree Nodes Acetals
Direct ParentKetals
Alternative Parents Gamma butyrolactones  Oxolanes  1,3-dioxolanes  Secondary alcohols  Carboxylic acid esters  1,2-diols  Oxacyclic compounds  Monocarboxylic acids and derivatives  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic heteromonocyclic compounds
Substituents Ketal - Gamma butyrolactone - Meta-dioxolane - Oxolane - 1,2-diol - Carboxylic acid ester - Secondary alcohol - Lactone - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carbonyl group - Organic oxide - Hydrocarbon derivative - Alcohol - Aliphatic heteromonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as ketals. These are acetals derived from ketones by replacement of the oxo group by two hydrocarbyloxy groups R2C(OR)2 ( R not Hydrogen ). This term, once abandoned, has been reinstated as a subclass of acetals.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propiedades químicas y físicas
SolubilidadSoluble in Methanol and Water
Punto de fusión (°C)166-170°C (lit.)
Peso molecular218.200 g/mol
XLogP3-1.000
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count1
Exact Mass218.079 Da
Monoisotopic Mass218.079 Da
Topological Polar Surface Area85.200 Ų
Heavy Atom Count15
Formal Charge0
Complexity276.000
Isotope Atom Count0
Defined Atom Stereocenter Count4
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 soluciones
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