Diisopropylcarbamoyl Chloride - ≥95% , CAS No.19009-39-3

CAS: 19009-39-3 Cat. No.: D154498 Peso molecular: 163.65 Número EC: 242-743-5

GRADE & PURITY ≥95%

Synonyms

BS-21962 | di-i-propylcarbamoyl chloride | diisopropylcarbamic chloride | Diisopropylcarbamoyl chloride | N,N-diisopropyl carbamoyl chloride | 8XK9CS659M | FT-0625008 | DIISOPROPYLCARBAMYL CHLORIDE | N,N-Diisopropylcarbamoyl chloride | J-640326 | D90257 |

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Descripción general

N,N-Diisopropylcarbamoyl chloride may be used in the preparation of: · 1-aryl-1-alkenyl N,N-diisopropylcarbamates · 1,3-diphenylallyl carbamate · (Z)-1,3-diphenyl-1-propenyl N,N-diisopropylcarbamate · (R)-1-(2-methoxy-4-methylphenyl)ethyl diisopropyl-carbamate

Specifications

Sinónimos

BS-21962 | di-i-propylcarbamoyl chloride | diisopropylcarbamic chloride | Diisopropylcarbamoyl chloride | N, N-diisopropyl carbamoyl chloride | 8XK9CS659M | FT-0625008 | DIISOPROPYLCARBAMYL CHLORIDE | N, N-Diisopropylcarbamoyl chloride | J-640326 | D90257 |

Especificaciones y pureza

≥95%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Argon charged

Enviado en

Wet ice

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

Pureza

≥95%

Nombres e identificadores

• Sonrisas canónicas: CC(C)N(C(C)C)C(=O)Cl
• IUPAC Name: N,N-di(propan-2-yl)carbamoyl chloride
• InChIKey: RSAFAYLZKCYUQW-UHFFFAOYSA-N
• INCHI: 1S/C7H14ClNO/c1-5(2)9(6(3)4)7(8)10/h5-6H,1-4H3
• Isómeros SMILES: CC(C)N(C(C)C)C(=O)Cl
• WGK Alemania: 3
• Número ONU: 3261
• Grupo de embalaje: II
• Peso molecular: 163.65
• Reaxy-Rn: 1754834
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1754834&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Carbamic acids and derivatives
            • Level7 Carbamic acid halides

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives - Carbamic acids and derivatives
• Direct Parent: Carbamic acid halides
• Alternative Parents: Organic carbonic acids and derivatives Organopnictogen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Carbonic acid derivative - Carbamic acid halide - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Carbonyl group - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as carbamic acid halides. These are compounds containing a carbamic acid derivative linked to a halogen atom.
• 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

Propiedades químicas y físicas

• Sensibilidad: Moisture sensitive.
• Punto de ebullición (°C): 90-93 °C/15 mmHg
• Punto de fusión (°C): 57-59°C
• Peso molecular: 163.640 g/mol
• XLogP3: 2.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 163.076 Da
• Monoisotopic Mass: 163.076 Da
• Topological Polar Surface Area: 20.300 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 115.000
• 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