1-Chloro-2,3-difluorobenzene - ≥98% , CAS No.36556-47-5

CAS: 36556-47-5 Cat. No.: C193007 Summenformel: C₆H₃ClF₂ Molekulargewicht: 148.54 EG-Nummer: 817-201-1

QUALITÄT & REINHEIT ≥98%

Synonyms

AM61930 | AC-4517 | GS-3400 | MFCD04112584 | 1-chloro-2,3-difluorobenzene | DTXSID80382275 | A20476 | ZBNCSBMIRFHJEL-UHFFFAOYSA-N | AKOS005064097 | Benzene, 1-chloro-2,3-difluoro- | SCHEMBL1039840 | 2,3-Difluorochlorobenzene | SY064704 | EN300-117090 | ch

Storage

Room temperature

Shipped In

Normal

Spezifikationen

Synonyme

AM61930 | AC-4517 | GS-3400 | MFCD04112584 | 1-chloro-2,3-difluorobenzene | DTXSID80382275 | A20476 | ZBNCSBMIRFHJEL-UHFFFAOYSA-N | AKOS005064097 | Benzene, 1-chloro-2,3-difluoro- | SCHEMBL1039840 | 2,3-Difluorochlorobenzene | SY064704 | EN300-117090 | ch

Spezifikationen & Reinheit

≥98%

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥98%

Namen und Kennungen

Pubchem Sid

528754466

Kanonisches Lächeln

C1=CC(=C(C(=C1)Cl)F)F

IUPAC Name

1-chloro-2,3-difluorobenzene

InChIKey

ZBNCSBMIRFHJEL-UHFFFAOYSA-N

INCHI

1S/C6H3ClF2/c7-4-2-1-3-5(8)6(4)9/h1-3H

Isomere SMILES

C1=CC(=C(C(=C1)Cl)F)F

Molekulargewicht

148.54

Reaxy-Rn

2207095

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2207095&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Benzene and substituted derivatives
      • Subclass Halobenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Benzene and substituted derivatives
• Subclass: Halobenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Fluorobenzenes
• Alternative Parents: Chlorobenzenes Aryl fluorides Aryl chlorides Organofluorides Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Fluorobenzene - Chlorobenzene - Aryl halide - Aryl fluoride - Aryl chloride - Hydrocarbon derivative - Organofluoride - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as fluorobenzenes. These are compounds containing one or more fluorine atoms attached to a benzene ring.
• 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

Chemische und physikalische Eigenschaften

• Molekulargewicht: 148.540 g/mol
• XLogP3: 2.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 147.989 Da
• Monoisotopic Mass: 147.989 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 97.100
• 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