2,2-Difluoroethanamine hydrochloride - ≥98% , CAS No.79667-91-7

CAS: 79667-91-7 Cat. No.: D590935 Formula: C₂H₆ClF₂N Peso molecolare: 117.53 Numero EC: 810-381-2

GRADE & PURITY ≥98%

Synonyms

SCHEMBL1031409 | MFCD04038283 | A839733 | difluoroethylamine hydrochloride | 2,2-Difluoroethan-1-amine--hydrogen chloride (1/1) | EN300-96615 | FT-0666830 | BCP34612 | 2,2-Difluoroethanamine, HCl | 2,2-difluoroethylamine hydrochloride, AldrichCPR | DTXSID

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Panoramica

2,2-Difluoroethylamine hydrochloride was recently reported to be used as a precursor for the "elusive" difluoromethyl diazomethane species (CF2HCHN2). The difluoromethyl diazomethane intermediate can be generated in situ in the presence of tert-butyl nitrite and a catalytic amount of acetic acid.

Specifications

Sinonimi

SCHEMBL1031409 | MFCD04038283 | A839733 | difluoroethylamine hydrochloride | 2,2-Difluoroethan-1-amine--hydrogen chloride (1/1) | EN300-96615 | FT-0666830 | BCP34612 | 2,2-Difluoroethanamine, HCl | 2,2-difluoroethylamine hydrochloride, AldrichCPR | DTXSID

Specifiche e purezza

≥98%

Condizioni di conservazione di stoccaggio

Store at 2-8°C,Protected from light,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

≥98%

Nomi e identificatori

Pubchem Sid

528755119

Sorrisi canonici

C(C(F)F)N.Cl

IUPAC Name

2,2-difluoroethanamine;hydrochloride

InChIKey

YSVKPVHTHFECBE-UHFFFAOYSA-N

INCHI

1S/C2H5F2N.ClH/c3-2(4)1-5;/h2H,1,5H2;1H

Isomeri SMILES

C(C(F)F)N.Cl

Peso molecolare

117.53

Reaxy-Rn

3668501

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3668501&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Classe Organofluorides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Classe: Organofluorides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organofluorides
• Alternative Parents: Organopnictogen compounds Monoalkylamines Hydrochlorides Hydrocarbon derivatives Alkyl fluorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Hydrochloride - Primary amine - Organonitrogen compound - Organofluoride - Primary aliphatic amine - Amine - Alkyl halide - Alkyl fluoride - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as organofluorides. These are compounds containing a chemical bond between a carbon atom and a fluorine 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

Proprietà chimiche e fisiche

• Sensibilità: Light sensitive
• Punto di fusione (°C): 132-137 °C (w/decomp)
• Peso molecolare: 117.520 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 117.016 Da
• Monoisotopic Mass: 117.016 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 21.600
• 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: 2

XLogP3