에틸 이소프로필 황화물 - ≥98%(GC) , CAS No.5145-99-3

CAS: 5145-99-3 Cat. No.: E156349 분자식: C₅H₁₂S 분자량: 104.21 EC 번호: 225-917-5

GRADE & PURITY ≥98%(GC)

Synonyms

Ethyl isopropyl sulphide | Isopropyl ethyl sulphide | E0225 | 2-(Ethylsulfanyl)propane # | 2-ethylsulfanylpropane | D90463 | ETHYLISOPROPYLSULFIDE | Isopropyl ethyl sulfide | Propane, 2-(ethylthio)- | FT-0635561 | 2-Methyl-3-thiapentane | 9FM2V7QR4Z | NZU

Storage

Store at 2-8°C,Desiccated

Shipped In

보통

Specifications

동의어

Ethyl isopropyl sulphide | Isopropyl ethyl sulphide | E0225 | 2-(Ethylsulfanyl)propane # | 2-ethylsulfanylpropane | D90463 | ETHYLISOPROPYLSULFIDE | Isopropyl ethyl sulfide | Propane, 2-(ethylthio)- | FT-0635561 | 2-Methyl-3-thiapentane | 9FM2V7QR4Z | NZU

사양 및 순도

≥98%(GC)

보관 조건

Store at 2-8°C,Desiccated

배송

보통

순수함

≥98%(GC)

이름과 식별자

• 정식 스마일: CCSC(C)C
• IUPAC Name: 2-ethylsulfanylpropane
• InChIKey: NZUQQADVSXWVNW-UHFFFAOYSA-N
• INCHI: 1S/C5H12S/c1-4-6-5(2)3/h5H,4H2,1-3H3
• 이성체 SMILES: CCSC(C)C
• 분자량: 104.21
• Reaxy-Rn: 1730947
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1730947&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organosulfur compounds
    • 분류 Thioethers
      • Subclass Dialkylthioethers

• Kingdom: Organic compounds
• Superclass: Organosulfur compounds
• 분류: Thioethers
• Subclass: Dialkylthioethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Dialkylthioethers
• Alternative Parents: Sulfenyl compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Dialkylthioether - Sulfenyl compound - Hydrocarbon derivative - Aliphatic acyclic compound
• 설명: This compound belongs to the class of organic compounds known as dialkylthioethers. These are organosulfur compounds containing a thioether group that is substituted by two alkyl groups.
• External Descriptors: Not available

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

화학 및 물리적 특성

• 감도: Moisture sensitive
• 굴절률: 1.4390 to 1.4430
• 발화점(°C): 5 °C
• 끓는점(°C): 103°C
• 분자량: 104.220 g/mol
• XLogP3: 2.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 104.066 Da
• Monoisotopic Mass: 104.066 Da
• Topological Polar Surface Area: 25.300 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 25.100
• 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