3,3′-Thiodipropionic acid - for synthesis , CAS No.111-17-1

CAS: 111-17-1 Cat. No.: T431470 Fórmula: C6H10O4S Peso molecular: 178.21 Beilstein Registry Number: 1210299 Número EC: 203-841-3 PubChem CID: 8096
Disponible para pedir
GRADE & PURITY for Synthesis ? Synthesis grade — practical purity for chemical synthesis and preparative work. Use as a cost-effective reagent when analytical purity isn't required.
Synonyms
DTXCID6024200 | THIODIPROPIONIC ACID [INCI] | .beta.,.beta.'-Thiodipropionic acid | 3-(2-carboxyethylsulfanyl)propanoic acid | Kyselina .beta.,.beta.'-thiodipropionova | NSC 8166 | Q2823309 | 3,3-Thiodipropionicacid | 3,3'-Thiobispropanoic acid | 3,3'-Thi
Storage
Room temperature
Shipped In
Normal
★
Size
Alemania (EU)
USA*
Price
Qty
250g
T431470-250g
1 Disponible
2 Disponible

65,86€

77,14€
Guardar 11,28 € (14.62%)
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Why this grade

for synthesis para «Síntesis» for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal 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 10 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
DTXCID6024200 | THIODIPROPIONIC ACID [INCI] | .beta.,.beta.'-Thiodipropionic acid | 3-(2-carboxyethylsulfanyl)propanoic acid | Kyselina .beta.,.beta.'-thiodipropionova | NSC 8166 | Q2823309 | 3,3-Thiodipropionicacid | 3,3'-Thiobispropanoic acid | 3,3'-Thi
Especificaciones y pureza
for synthesis
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Grado
para «Síntesis»
Nombres e identificadores
Pubchem Sid528757808
Sonrisas canónicasC(CSCCC(=O)O)C(=O)O
IUPAC Name3-(2-carboxyethylsulfanyl)propanoic acid
InChIKeyODJQKYXPKWQWNK-UHFFFAOYSA-N
INCHI1S/C6H10O4S/c7-5(8)1-3-11-4-2-6(9)10/h1-4H2,(H,7,8)(H,9,10)
Isómeros SMILES C(CSCCC(=O)O)C(=O)O
WGK Alemania 2
RTECS UF7990000
PubChem CID 8096
Peso molecular 178.21
Beilstein 1210299

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 acids and derivatives
ClaseCarboxylic acids and derivatives
SubclassDicarboxylic acids and derivatives
Intermediate Tree Nodes Not available
Direct ParentDicarboxylic acids and derivatives
Alternative Parents Fatty acids and conjugates  Sulfenyl compounds  Dialkylthioethers  Carboxylic acids  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic acyclic compounds
Substituents Fatty acid - Dicarboxylic acid or derivatives - Dialkylthioether - Sulfenyl compound - Thioether - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
DescripciónThis compound belongs to the class of organic compounds known as dicarboxylic acids and derivatives. These are organic compounds containing exactly two carboxylic acid groups.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





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Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

1 results found

Lot NumberCertificate TypeFechaArticulo
G2312033Certificate of AnalysisApr 07, 2026 T431470
Propiedades químicas y físicas
Punto de inflamación (°C)128℃
Punto de fusión (°C)130-133°C
Peso molecular178.210 g/mol
XLogP3-0.100
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass178.03 Da
Monoisotopic Mass178.03 Da
Topological Polar Surface Area99.900 Ų
Heavy Atom Count11
Formal Charge0
Complexity130.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Preguntas frecuentes y artículos
Citations of This Product
Calculadoras de soluciones
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