Spiro[bicyclo[3.2.1]octane-8,2'-[1,3]dithiolane]-3-carboxylic acid - ≥95% , CAS No.956437-13-1

CAS: 956437-13-1 Cat. No.: S968060 Peso molecular: 244.400
Disponible para pedir
GRADE & PURITY ≥95%
Storage
Room temperature
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
50mg
S968060-50mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
563,90US$
100mg
S968060-100mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
700,90US$
250mg
S968060-250mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
877,90US$
500mg
S968060-500mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
1.222,90US$
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Why this grade

≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Check lot-specific COA for exact specifications.

📋

Quality documents

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

📚

Literature proof

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

Specifications

Especificaciones y pureza
≥95%
Condiciones de almacenamiento de almacenamiento
Room temperature
Pureza
≥95%
Nombres e identificadores
Sonrisas canónicasC1CC2CC(CC1C23SCCS3)C(=O)O
IUPAC Namespiro[1,3-dithiolane-2,8'-bicyclo[3.2.1]octane]-3'-carboxylic acid
InChIKeyARWRLJKIYGMGBT-UHFFFAOYSA-N
INCHI1S/C11H16O2S2/c12-10(13)7-5-8-1-2-9(6-7)11(8)14-3-4-15-11/h7-9H,1-6H2,(H,12,13)
Peso molecular 244.400

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
SuperclassOrganosulfur compounds
ClaseThioacetals
SubclassDithioacetals
Intermediate Tree Nodes Not available
Direct ParentDithioketals
Alternative Parents 1,3-dithiolanes  Monocarboxylic acids and derivatives  Dialkylthioethers  Carboxylic acids  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic heteropolycyclic compounds
Substituents Dithioketal - 1,3-dithiolane - Dithiolane - Organoheterocyclic compound - Dialkylthioether - Thioether - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as dithioketals. These are compounds containing a dithioketal functional group with the general structure R2C(SR')2 with R, R' = organyl.
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
Peso molecular244.400 g/mol
XLogP32.300
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass244.059 Da
Monoisotopic Mass244.059 Da
Topological Polar Surface Area87.900 Ų
Heavy Atom Count15
Formal Charge0
Complexity270.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
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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