1-Propanethiol(1-PP) - Standard for GC, ≥99.5%(GC) , CAS No.107-03-9

CAS: 107-03-9 Cat. No.: P103444 Peso molecular: 76.16 Beilstein Registry Number: 1696860 Número EC: 203-455-5

GRADE & PURITY Standard for GC, ≥99.5%(GC)

Synonyms

1-Propanethiol|Propane-1-thiol|Propanethiol|107-03-9|PROPYL MERCAPTAN|n-Propylmercaptan|n-Propyl mercaptan|n-Propylthiol|1-Mercaptopropane|1-Propylmercaptan|Propylthiol|1-Propyl mercaptan|Thiopropyl alcohol|n-Thiopropyl alcohol|1-propylthiol|FEMA No. 3521

Storage

Room temperature,Argon charged

Shipped In

FedEx DG Service

Specifications

Sinónimos

1-Propanethiol | Propane-1-thiol | Propanethiol | 107-03-9 | PROPYL MERCAPTAN | n-Propylmercaptan | n-Propyl mercaptan | n-Propylthiol | 1-Mercaptopropane | 1-Propylmercaptan | Propylthiol | 1-Propyl mercaptan | Thiopropyl alcohol | n-Thiopropyl alcohol | 1-propylthiol | FEMA No. 3521

Especificaciones y pureza

Standard for GC, ≥99.5%(GC)

Condiciones de almacenamiento de almacenamiento

Room temperature, Argon charged

Enviado en

FedEx DG Service

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Grado

Standard for GC

Pureza

≥99.5%(GC)

Nombres e identificadores

• Sonrisas canónicas: CCCS
• IUPAC Name: propane-1-thiol
• InChIKey: SUVIGLJNEAMWEG-UHFFFAOYSA-N
• INCHI: 1S/C3H8S/c1-2-3-4/h4H,2-3H2,1H3
• Isómeros SMILES: CCCS
• WGK Alemania: 3
• RTECS: TZ7300000
• Número ONU: 2402
• Grupo de embalaje: II
• Peso molecular: 76.16
• Beilstein: 1696860

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organosulfur compounds
• Clase: 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
• Descripción: 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: alkanethiol

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

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Slightly soluble in water, soluble in ethanol, ether, etc.
• Sensibilidad: Air sensitive
• Índice de refracción: 1.438
• Punto de inflamación (°F): 68℉
• Punto de inflamación (°C): -20℃
• Punto de ebullición (°C): 67.73°C
• Punto de fusión (°C): -113.3°C
• Peso molecular: 76.160 g/mol
• XLogP3: 1.800
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 76.0347 Da
• Monoisotopic Mass: 76.0347 Da
• Topological Polar Surface Area: 1.000 Ų
• Heavy Atom Count: 4
• Formal Charge: 0
• Complexity: 7.200
• 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

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