Bis(2-hydroxyethyl) Disulfide - ca. 50% in Water , CAS No.1892-29-1

CAS: 1892-29-1 Cat. No.: B298701 Formula: C₄H₁₀O₂S₂ Peso molecolare: 154.24 Beilstein Registry Number: 1471 Numero EC: 217-576-6

QUALITÀ & PUREZZA ca. 50% in Water

Synonyms

Tox21_302181 | 2,2'-Disulfanediylbis(ethan-1-ol) | MFCD00002906 | NSC33920 | NSC-33920 | USAF TH-9 | J-012208 | DTXSID4044404 | E82252 | 2,2'-Dithiodiethanol | 2,2-dithiodiethanol | 2-hydroxy ethyldisulfide | Hydroxyethyl disulfide | InChI=1/C4H10O2S2/c5-

Storage

Room temperature

Shipped In

Normal

Specifiche

Sinonimi

Tox21_302181 | 2,2'-Disulfanediylbis(ethan-1-ol) | MFCD00002906 | NSC33920 | NSC-33920 | USAF TH-9 | J-012208 | DTXSID4044404 | E82252 | 2,2'-Dithiodiethanol | 2,2-dithiodiethanol | 2-hydroxy ethyldisulfide | Hydroxyethyl disulfide | InChI=1/C4H10O2S2/c5-

Specifiche e purezza

ca. 50% in Water

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Nomi e identificatori

Pubchem Sid

508812677

Sorrisi canonici

C(CSSCCO)O

IUPAC Name

2-(2-hydroxyethyldisulfanyl)ethanol

InChIKey

KYNFOMQIXZUKRK-UHFFFAOYSA-N

INCHI

1S/C4H10O2S2/c5-1-3-7-8-4-2-6/h5-6H,1-4H2

Isomeri SMILES

C(CSSCCO)O

RTECS

KK7525000

Peso molecolare

154.24

Beilstein

1471

Reaxy-Rn

1735851

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1735851&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organosulfur compounds
    • Classe Organic disulfides
      • Subclass Dialkyldisulfides

• Kingdom: Organic compounds
• Superclass: Organosulfur compounds
• Classe: Organic disulfides
• Subclass: Dialkyldisulfides
• Intermediate Tree Nodes: Not available
• Direct Parent: Dialkyldisulfides
• Alternative Parents: Sulfenyl compounds Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Dialkyldisulfide - Sulfenyl compound - Organic oxygen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Alcohol - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as dialkyldisulfides. These are organic compounds containing a disulfide group R-SS-R' where R and R' are both alkyl groups.
• External Descriptors: a small molecule

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Proprietà chimiche e fisiche

• Indice di rifrazione: 1.57
• Punto di infiammabilità (°F): 233.6 °F
• Punto di infiammabilità (°C): >110 ℃
• Punto di ebollizione (°C): 158-163℃
• Punto di fusione (°C): 25℃
• Peso molecolare: 154.300 g/mol
• XLogP3: -0.500
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 154.012 Da
• Monoisotopic Mass: 154.012 Da
• Topological Polar Surface Area: 91.100 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 37.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1