Tetradecane - ≥99% , CAS No.629-59-4

CAS: 629-59-4 Cat. No.: T100023 Formula: CH₃(CH₂)₁₂CH₃ Molecular Weight: 198.39 Beilstein Registry Number: 1733859 EC Number: 211-096-0

GRADE & PURITY ≥99%

Synonyms

Tetradecane_GurudeebanSatyavani | CAS-629-59-4 | n-Tetradecane 10 microg/mL in Hexane | NCGC00257151-01 | Tetradekan | DTXSID1027267 | CH3-[CH2]12-CH3 | CHEBI:41253 | HSDB 5728 | Q150808 | DTXSID101022622 | FT-0632666 | AS-56340 | NSC72440 | NSC-72440 | N

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

Tetradecane_GurudeebanSatyavani | CAS-629-59-4 | n-Tetradecane 10 microg/mL in Hexane | NCGC00257151-01 | Tetradekan | DTXSID1027267 | CH3-[CH2]12-CH3 | CHEBI:41253 | HSDB 5728 | Q150808 | DTXSID101022622 | FT-0632666 | AS-56340 | NSC72440 | NSC-72440 | N

Specifications & Purity

≥99%

Storage

Room temperature

Shipped In

Normal

Purity

≥99%

Names and Identifiers

• Pubchem Sid: 488181648
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488181648
• Canonical Smiles: CCCCCCCCCCCCCC
• IUPAC Name: tetradecane
• InChIKey: BGHCVCJVXZWKCC-UHFFFAOYSA-N
• INCHI: 1S/C14H30/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h3-14H2,1-2H3
• Isomeric SMILES: CCCCCCCCCCCCCC
• WGK Germany: 3
• RTECS: XB8000000
• Molecular Weight: 198.39
• Beilstein: 1733859
• Reaxy-Rn: 1733859
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1733859&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Hydrocarbons
    • Class Saturated hydrocarbons
      • Subclass Alkanes

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• Class: Saturated hydrocarbons
• Subclass: Alkanes
• Intermediate Tree Nodes: Not available
• Direct Parent: Alkanes
• Alternative Parents: Not available
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Acyclic alkane - Alkane - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as alkanes. These are acyclic branched or unbranched hydrocarbons having the general formula CnH2n+2 , and therefore consisting entirely of hydrogen atoms and saturated carbon atoms.
• External Descriptors: Hydrocarbons

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: Insoluble in water; Soluble in Acetone,Ether,Alcohol
• Sensitivity: Moisture sensitive.
• x_refractive_index: 1.429
• x_flash_point_drop_centigrade: 100℃
• x_boil_point_char: 253.7°C
• x_melt_point_char: 5.86°C
• Molecular Weight: 198.390 g/mol
• XLogP3: 7.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 11
• Exact Mass: 198.235 Da
• Monoisotopic Mass: 198.235 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 74.000
• 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

Frequently Asked Questions

What is the purity of this product?

This product is supplied at ≥99% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 629-59-4, the molecular formula is C14H30, and the molecular weight is 198.39 g/mol. InChIKey BGHCVCJVXZWKCC-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.