3-Chloropropionamid - ≥98% , CAS No.5875-24-1

CAS: 5875-24-1 Cat. No.: C171099 Summenformel: C₃H₆ClNO Molekulargewicht: 107.54 EG-Nummer: 227-542-2

GRADE & PURITY ≥98%

Synonyms

3-Chloropropanamide | 3-chloro-propanamide | BDBM50224816 | STL146565 | 3-Chloropropionamide, 98% | S12033 | 3-Chloropropanamide # | SCHEMBL120934 | UNII-1A4DT52KJV | SCHEMBL10439099 | NSC 401789 | .BETA.-CHLOROPROPIONAMIDE | EINECS 227-542-2 | NSC-10824

Storage

Raumtemperatur

Shipped In

Normal

Specifications

Synonyme

3-Chloropropanamide | 3-chloro-propanamide | BDBM50224816 | STL146565 | 3-Chloropropionamide, 98% | S12033 | 3-Chloropropanamide # | SCHEMBL120934 | UNII-1A4DT52KJV | SCHEMBL10439099 | NSC 401789 | .BETA.-CHLOROPROPIONAMIDE | EINECS 227-542-2 | NSC-10824

Spezifikationen & Reinheit

≥98%

Storage

Raumtemperatur

Verschickt in

Normal

Reinheit

≥98%

Namen und Kennungen

Pubchem Sid

504755430

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504755430

Kanonisches Lächeln

C(CCl)C(=O)N

IUPAC Name

3-chloropropanamide

InChIKey

JQDXZJYAUSVHDH-UHFFFAOYSA-N

INCHI

1S/C3H6ClNO/c4-2-1-3(5)6/h1-2H2,(H2,5,6)

Isomere SMILES

C(CCl)C(=O)N

WGK Deutschland

3

Molekulargewicht

107.54

Reaxy-Rn

1740457

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1740457&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Klasse Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives
        • Ebene5 Carboxylic acid amides
          • Ebene6 Primary carboxylic acid amides

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Klasse: Carboxylic acids and derivatives
• Subclass: Carboxylic acid derivatives
• Intermediate Tree Nodes: Carboxylic acid amides
• Direct Parent: Primary carboxylic acid amides
• Alternative Parents: Organopnictogen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl chlorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Primary carboxylic acid amide - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as primary carboxylic acid amides. These are compounds comprising primary carboxylic acid amide functional group, with the general structure RC(=O)NH2.
• 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

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Schmelzpunkt (°C): 98-101 °C
• Molekulargewicht: 107.540 g/mol
• XLogP3: -0.300
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 107.014 Da
• Monoisotopic Mass: 107.014 Da
• Topological Polar Surface Area: 43.100 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 54.800
• 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

Häufig gestellte Fragen

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 5875-24-1, the molecular formula is C3H6ClNO, and the molecular weight is 107.54 g/mol. InChIKey JQDXZJYAUSVHDH-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.