3-[(2-Mercapto-1-methylpropyl)thio]-2-butanol - ≥95% , CAS No.54957-02-7

CAS: 54957-02-7 Cat. No.: M1060420 Peso molecular: 194.36 Número EC: 639-065-0 PubChem CID: 62090
Disponible para pedir
GRADE & PURITY ≥95%
Synonyms
α-Methyl-β-hydroxypropyl α-methyl-β-mer-captopropylsulfide | 3-((3-Mercaptobutan-2-yl)thio)butan-2-ol
Storage
Store at 2-8°C,Desiccated
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
100mg
M1060420-100mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
199,90US$
500mg
M1060420-500mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
599,90US$
1g
M1060420-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
1.036,90US$
Enter a quantity for the sizes you want to add.
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Why this grade

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

🌡

Storage & shipping

Store at 2-8°C,Desiccated Ships Wet ice 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

Sinónimos
α-Methyl-β-hydroxypropyl α-methyl-β-mer-captopropylsulfide | 3-((3-Mercaptobutan-2-yl)thio)butan-2-ol
Especificaciones y pureza
≥95%
Condiciones de almacenamiento de almacenamiento
Store at 2-8°C, Desiccated
Enviado en
Wet ice
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Pureza
≥95%
Nombres e identificadores
Sonrisas canónicasCC(C(C)SC(C)C(C)S)O
IUPAC Name3-(3-sulfanylbutan-2-ylsulfanyl)butan-2-ol
InChIKeyPHLKBLKTWMSFGF-UHFFFAOYSA-N
INCHI1S/C8H18OS2/c1-5(9)7(3)11-8(4)6(2)10/h5-10H,1-4H3
Isómeros SMILES CC(C(C)SC(C)C(C)S)O
PubChem CID 62090
Peso molecular 194.36

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
SubclassAlcohols and polyols
Intermediate Tree Nodes Not available
Direct ParentSecondary alcohols
Alternative Parents Sulfenyl compounds  Dialkylthioethers  Alkylthiols  Hydrocarbon derivatives  
Molecular FrameworkAliphatic acyclic compounds
Substituents Secondary alcohol - Dialkylthioether - Sulfenyl compound - Thioether - Alkylthiol - Hydrocarbon derivative - Organosulfur compound - Aliphatic acyclic compound
DescripciónThis compound belongs to the class of organic compounds known as secondary alcohols. These are compounds containing a secondary alcohol functional group, with the general structure HOC(R)(R') (R,R'=alkyl, aryl).
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:

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

3 results found

Lot NumberCertificate TypeFechaArticulo
F2616429Certificate of AnalysisMay 28, 2026 M1060420
F2616431Certificate of AnalysisMay 28, 2026 M1060420
F2616433Certificate of AnalysisMay 28, 2026 M1060420
Propiedades químicas y físicas
Sensibilidadair sensitive; Moisture sensitive
Peso molecular194.400 g/mol
XLogP32.200
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass194.08 Da
Monoisotopic Mass194.08 Da
Topological Polar Surface Area46.500 Ų
Heavy Atom Count11
Formal Charge0
Complexity108.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count4
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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