Dimethyl sulfite(DS) - ≥99% , CAS No.616-42-2

CAS: 616-42-2 Cat. No.: D106795 Peso molecular: 110.13 Beilstein Registry Number: 1700256 Número EC: 210-481-0

GRADE & PURITY ≥99%

Synonyms

Dimethyl sulfite | Methyl sulfite

Storage

Protected from light,Room temperature,Argon charged,Desiccated,Cool

Shipped In

Normal

Descripción general

Dimethyl sulfite is an insect repellent and also experimentally identified as a mutagenic agent.
The conformations and vibrational spectra of dimethyl sulfite was studied by matrix-isolation fourier transform infrared spectroscopy and to study its conformational selective aggregation. It may be used in organic synthesis.

Specifications

Sinónimos

Dimethyl sulfite | Methyl sulfite

Especificaciones y pureza

≥99%

Condiciones de almacenamiento de almacenamiento

Protected from light, Room temperature, Argon charged, Desiccated, Cool

Enviado en

Normal

Pureza

≥99%

Nombres e identificadores

• Pubchem Sid: 488184261
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488184261
• Sonrisas canónicas: COS(=O)OC
• IUPAC Name: dimethyl sulfite
• InChIKey: BDUPRNVPXOHWIL-UHFFFAOYSA-N
• INCHI: 1S/C2H6O3S/c1-4-6(3)5-2/h1-2H3
• Isómeros SMILES: COS(=O)OC
• WGK Alemania: 3
• RTECS: WT3512000
• Número ONU: 1993
• Peso molecular: 110.13
• Beilstein: 1700256
• Reaxy-Rn: 1700256
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1700256&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Clase Organooxygen compounds

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Clase: Organooxygen compounds
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organooxygen compounds
• Alternative Parents: Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as organooxygen compounds. These are organic compounds containing a bond between a carbon atom and an oxygen atom.
• External Descriptors: sulfite ester

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

Propiedades químicas y físicas

• Sensibilidad: Air sensitive
• Índice de refracción: 1.4085-1.4105
• Punto de inflamación (°F): 100.4 °F
• Punto de inflamación (°C): 30℃
• Punto de ebullición (°C): 126-127°C
• Peso molecular: 110.130 g/mol
• XLogP3: 0.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 110.004 Da
• Monoisotopic Mass: 110.004 Da
• Topological Polar Surface Area: 54.700 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 46.800
• 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

Referencias

1. Nie Kai, Liu Shaoyang, Zhao Tao, Tan Zhijian, Zhang Yuanming, Song Yan, Li Boya, Li Linlin, Lv Wanwan, Han Guangting, Jiang Wei.  (2022)  Efficient fractionation of biomass by acid deep eutectic solvent (DES) and rapid preparation of lignin nanoparticles.  Biomass Conversion and Biorefinery,      [PMID:] [10.1007/s13399-022-03496-9]

2. Hongxia Chen, Bin Liu, Ya Wang, Hao Guan, Hongming Zhou.  (2021)  Insight into wide temperature electrolyte based on lithiumdifluoro(oxalate)borate for high voltage lithium-ion batteries.  JOURNAL OF ALLOYS AND COMPOUNDS,      [PMID:] [10.1016/j.jallcom.2021.159966]

3. Xu Liu, Xinghao Sun, Xixi Shi, Dawei Song, Hongzhou Zhang, Chunliang Li, Kai-Yao Wang, Chengwei Xiao, Xizheng Liu, Lianqi Zhang.  (2020)  Low-temperature and high-performance Si/graphite composite anodes enabled by sulfite additive.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2020.127782]