Cyclohexene - ≥99%(GC) , CAS No.110-83-8

CAS: 110-83-8 Cat. No.: C112737 Formula: C₆H₁₀ Molecular Weight: 82.15 Beilstein Registry Number: 5,63 EC Number: 203-807-8

GRADE & PURITY ≥99%(GC)

Synonyms

Cyclohex-1-ene | CYCLOHEXENE [MI] | J-002481 | MFCD00001539 | A802251 | EINECS 203-807-8 | Benzene tetrahydride | CCRIS 8739 | Cykloheksen | AMY17792 | cylcohexene | 1,2,3,4-Tetrahydrobenzene

Storage

Room temperature

Shipped In

FedEx DG Service

Specifications

Synonyms

Cyclohex-1-ene | CYCLOHEXENE [MI] | J-002481 | MFCD00001539 | A802251 | EINECS 203-807-8 | Benzene tetrahydride | CCRIS 8739 | Cykloheksen | AMY17792 | cylcohexene | 1,2,3,4-Tetrahydrobenzene

Specifications & Purity

≥99%(GC)

Storage

Room temperature

Shipped In

FedEx DG Service

Purity

≥99%(GC)

Names and Identifiers

Pubchem Sid

508814715

Canonical Smiles

C1CCC=CC1

IUPAC Name

cyclohexene

InChIKey

HGCIXCUEYOPUTN-UHFFFAOYSA-N

INCHI

1S/C6H10/c1-2-4-6-5-3-1/h1-2H,3-6H2

Isomeric SMILES

C1CCC=CC1

WGK Germany

2

RTECS

GW2500000

UN Number

2256

Packing Group

II

Molecular Weight

82.15

Beilstein

5,63

Reaxy-Rn

906737

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=906737&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Hydrocarbons
    • Class Unsaturated hydrocarbons
      • Subclass Olefins
        • Level5 Cyclic olefins
          • Level6 Cycloalkenes

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• Class: Unsaturated hydrocarbons
• Subclass: Olefins
• Intermediate Tree Nodes: Cyclic olefins
• Direct Parent: Cycloalkenes
• Alternative Parents: Unsaturated aliphatic hydrocarbons
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Cycloalkene - Unsaturated aliphatic hydrocarbon - Aliphatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as cycloalkenes. These are unsaturated monocyclic hydrocarbons having one endocyclic double bond.
• External Descriptors: cycloalkene

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

Mechanisms of Action

Chemical and Physical Properties

• Solubility: Immiscible with cold water.
• x_refractive_index: 1.45
• x_flash_point_drop_centigrade: -6 °C
• x_boil_point_char: 83°C
• x_melt_point_char: -104 °C
• Molecular Weight: 82.140 g/mol
• XLogP3: 2.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 82.0783 Da
• Monoisotopic Mass: 82.0783 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 45.100
• 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