1，2-dibromocyclopentene - ≥97% , CAS No.75415-78-0

CAS: 75415-78-0 Cat. No.: D136728 Molecular Weight: 225.91 EC Number: 616-222-1

GRADE & PURITY ≥97%

Synonyms

1,2-Dibromocyclopentene | PNWFXPGGROADNS-UHFFFAOYSA-N | SY065374 | DTXSID50403305 | FT-0641563 | AKOS015834957 | 1,2-Dibromo-1-cyclopentene | 1,2-dibromocyclopent-1-ene | MFCD00010246 | 1,1-Cyclohexane diacetic acid(CDA) | 1,2-Dibromocyclopentene, 97% | S

Storage

Protected from light,Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Overview

1,2-Dibromocyclopentene undergoes single Br/Mg exchange reaction with iPrMgCl LiCl to yield the corresponding β-bromocyclopentenylmagnesium reagent
1,2-Dibromocyclopentene has been used in the synthesis of cyclopentene analogs.

Specifications

Synonyms

1, 2-Dibromocyclopentene | PNWFXPGGROADNS-UHFFFAOYSA-N | SY065374 | DTXSID50403305 | FT-0641563 | AKOS015834957 | 1, 2-Dibromo-1-cyclopentene | 1, 2-dibromocyclopent-1-ene | MFCD00010246 | 1, 1-Cyclohexane diacetic acid(CDA) | 1, 2-Dibromocyclopentene, 97% | S

Specifications & Purity

≥97%

Storage

Protected from light, Store at -20°C, Argon charged

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥97%

Names and Identifiers

• Canonical Smiles: C1CC(=C(C1)Br)Br
• IUPAC Name: 1,2-dibromocyclopentene
• InChIKey: PNWFXPGGROADNS-UHFFFAOYSA-N
• INCHI: 1S/C5H6Br2/c6-4-2-1-3-5(4)7/h1-3H2
• Isomeric SMILES: C1CC(=C(C1)Br)Br
• WGK Germany: 3
• Molecular Weight: 225.91
• Reaxy-Rn: 2498061
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2498061&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Class Vinyl halides
      • Subclass Vinyl bromides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Class: Vinyl halides
• Subclass: Vinyl bromides
• Intermediate Tree Nodes: Not available
• Direct Parent: Vinyl bromides
• Alternative Parents: Bromoalkenes Organobromides Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Bromoalkene - Haloalkene - Vinyl bromide - Hydrocarbon derivative - Organobromide - Aliphatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as vinyl bromides. These are vinyl halides in which a bromine atom is bonded to an sp2-hybridised carbon 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

Chemical and Physical Properties

• Sensitivity: Light sensitive
• Refractive Index: 1.5558
• Flash Point(°F): >235.4 °F
• Flash Point(°C): >113 °C
• Boil Point(°C): 78 °C
• Molecular Weight: 225.910 g/mol
• XLogP3: 2.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 225.882 Da
• Monoisotopic Mass: 223.884 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 92.600
• 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: 1