Undecylcyclohexane - ≥99% , CAS No.54105-66-7

CAS: 54105-66-7 Cat. No.: U162918 Formula: C₁₇H₃₄ Molecular Weight: 238.46 EC Number: 258-976-0 PubChem CID: 40997

GRADE & PURITY ≥99%

Synonyms

BS-23815 | MFCD00045505 | FT-0640220 | 1-Cyclohexylundecane | n-Undecylcyclohexane | U0037 | DTXSID50202451 | XQQVOBPJWHQXEN-UHFFFAOYSA-N | EINECS 258-976-0 | Cyclohexane, undecyl- | UNDECYLCYCLOHEXANE | undecyl-Cyclohexane | CHEBI:183291 | D92756

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

BS-23815 | MFCD00045505 | FT-0640220 | 1-Cyclohexylundecane | n-Undecylcyclohexane | U0037 | DTXSID50202451 | XQQVOBPJWHQXEN-UHFFFAOYSA-N | EINECS 258-976-0 | Cyclohexane, undecyl- | UNDECYLCYCLOHEXANE | undecyl-Cyclohexane | CHEBI:183291 | D92756

Specifications & Purity

≥99%

Storage

Room temperature

Shipped In

Normal

Purity

≥99%

Names and Identifiers

Canonical Smiles

CCCCCCCCCCCC1CCCCC1

IUPAC Name

undecylcyclohexane

InChIKey

XQQVOBPJWHQXEN-UHFFFAOYSA-N

INCHI

1S/C17H34/c1-2-3-4-5-6-7-8-9-11-14-17-15-12-10-13-16-17/h17H,2-16H2,1H3

Isomeric SMILES

CCCCCCCCCCCC1CCCCC1

PubChem CID

40997

Molecular Weight

238.46

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• Class: Saturated hydrocarbons
• Subclass: Cycloalkanes
• Intermediate Tree Nodes: Not available
• Direct Parent: Cycloalkanes
• Alternative Parents: Not available
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Cycloalkane - Aliphatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as cycloalkanes. These are saturated monocyclic hydrocarbons (with or without side chains).
• 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

• Refractive Index: 1.45
• Flash Point(°C): 138 °C
• Boil Point(°C): 165°C/10mmHg(lit.)
• Molecular Weight: 238.500 g/mol
• XLogP3: 8.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 10
• Exact Mass: 238.266 Da
• Monoisotopic Mass: 238.266 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 144.000
• 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

How should this product be stored?

Store at room temperature.

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 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 54105-66-7, the molecular formula is C17H34, and the molecular weight is 238.46 g/mol. InChIKey XQQVOBPJWHQXEN-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.