1-Hexadecene - ≥99% , CAS No.629-73-2

CAS: 629-73-2 Cat. No.: H103615 Formula: C₁₆H₃₂ Molecular Weight: 224.43 Beilstein Registry Number: 1753401 EC Number: 211-105-8

GRADE & PURITY ≥99%

Synonyms

1-Hexadecene 10 microg/mL in Cyclohexane | Gulftene 16 | 1-Hexadecene, >=98.5% | 97T015M2UX | Alkenes, C14-18 .alpha.- | 1-Hexadecene | 1-Hexadecene, analytical standard | ?1-Hexadecene | Hexadecene-1 | Hexadecene, 1- | .alpha.-Hexadecene | Hexadecylene-1

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonyms

1-Hexadecene 10 microg/mL in Cyclohexane | Gulftene 16 | 1-Hexadecene, >=98.5% | 97T015M2UX | Alkenes, C14-18 .alpha.- | 1-Hexadecene | 1-Hexadecene, analytical standard | ?1-Hexadecene | Hexadecene-1 | Hexadecene, 1- | .alpha.-Hexadecene | Hexadecylene-1

Specifications & Purity

≥99%

Storage

Room temperature,Argon charged

Shipped In

Normal

Purity

≥99%

Names and Identifiers

Pubchem Sid

508812576

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/508812576

Canonical Smiles

CCCCCCCCCCCCCCC=C

IUPAC Name

hexadec-1-ene

InChIKey

GQEZCXVZFLOKMC-UHFFFAOYSA-N

INCHI

1S/C16H32/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h3H,1,4-16H2,2H3

Isomeric SMILES

CCCCCCCCCCCCCCC=C

WGK Germany

1

RTECS

MM0479000

Molecular Weight

224.43

Beilstein

1753401

Reaxy-Rn

1753401

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1753401&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Hydrocarbons
    • Class Unsaturated hydrocarbons
      • Subclass Unsaturated aliphatic hydrocarbons

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• Class: Unsaturated hydrocarbons
• Subclass: Unsaturated aliphatic hydrocarbons
• Intermediate Tree Nodes: Not available
• Direct Parent: Unsaturated aliphatic hydrocarbons
• Alternative Parents: Alkenes
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Unsaturated aliphatic hydrocarbon - Olefin - Alkene - Acyclic olefin - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as unsaturated aliphatic hydrocarbons. These are aliphatic Hydrocarbons that contains one or more unsaturated carbon atoms. These compounds contain one or more double or triple bonds.
• External Descriptors: alkene

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

• Solubility: Miscible with ether, petroleum ether and alcohol. Immiscible with water.
• x_refractive_index: 1.44
• x_flash_point_drop_fahrenheit: 269.6 °F
• x_flash_point_drop_centigrade: 132 °C
• x_boil_point_char: 285°C
• x_melt_point_char: 4 °C
• Molecular Weight: 224.420 g/mol
• XLogP3: 8.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 13
• Exact Mass: 224.25 Da
• Monoisotopic Mass: 224.25 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 126.000
• 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