1-Eicosanethiol - ≥95%(GC) , CAS No.13373-97-2

CAS: 13373-97-2 Cat. No.: E156181 Formula: C₂₀H₄₂S Peso molecolare: 314.62 Numero EC: 603-761-2

QUALITÀ & PUREZZA ≥95%(GC)

Synonyms

2-METHOXYCARBONYLAMINO-3H-BENZOIMIDAZOLE-5-CARBOXYLICACID | eicosanethiol | 1-icosanethiol | MFCD07779406 | 1-Eicosanethiol | ECT | AKOS025396826 | DTXSID70158345 | Icosyl Mercaptan | E0832 | Eicosyl Mercaptan | icosane-1-thiol | T71724 | SCHEMBL271560

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifiche

Sinonimi

2-METHOXYCARBONYLAMINO-3H-BENZOIMIDAZOLE-5-CARBOXYLICACID | eicosanethiol | 1-icosanethiol | MFCD07779406 | 1-Eicosanethiol | ECT | AKOS025396826 | DTXSID70158345 | Icosyl Mercaptan | E0832 | Eicosyl Mercaptan | icosane-1-thiol | T71724 | SCHEMBL271560

Specifiche e purezza

≥95%(GC)

Condizioni di conservazione di stoccaggio

Store at 2-8°C,Argon charged

Spedito in

Wet ice

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Purezza

≥95%(GC)

Nomi e identificatori

Pubchem Sid

528754350

Sorrisi canonici

CCCCCCCCCCCCCCCCCCCCS

IUPAC Name

icosane-1-thiol

InChIKey

YYHYWOPDNMFEAV-UHFFFAOYSA-N

INCHI

1S/C20H42S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21/h21H,2-20H2,1H3

Isomeri SMILES

CCCCCCCCCCCCCCCCCCCCS

Peso molecolare

314.62

Reaxy-Rn

1763630

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1763630&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organosulfur compounds
    • Classe Thiols
      • Subclass Alkylthiols

• Kingdom: Organic compounds
• Superclass: Organosulfur compounds
• Classe: Thiols
• Subclass: Alkylthiols
• Intermediate Tree Nodes: Not available
• Direct Parent: Alkylthiols
• Alternative Parents: Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alkylthiol - Hydrocarbon derivative - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as alkylthiols. These are organic compounds containing the thiol functional group linked to an alkyl chain.
• 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

Proprietà chimiche e fisiche

• Sensibilità: Air sensitive
• Punto di ebollizione (°C): 389°C(lit.)
• Punto di fusione (°C): 40 °C
• Peso molecolare: 314.600 g/mol
• XLogP3: 10.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 18
• Exact Mass: 314.301 Da
• Monoisotopic Mass: 314.301 Da
• Topological Polar Surface Area: 1.000 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 167.000
• 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