2-Hexyl-1-decanol - ≥97%, used for 2-Hexyl-1-decanol may be employed as an organic solvent to study the extraction of non-polar acidic drugs from human plasma by parallel artificial liquid membrane extraction (PALME). various applications , CAS No.2425-77

CAS: 2425-77-6 Cat. No.: H138544 Formula: CH₃(CH₂)₇CH[(CH₂)₅CH₃]CH₂OH Molecular Weight: 242.44 EC Number: 219-370-1

GRADE & PURITY ≥97%

Synonyms

HEXYLDECANOL [INCI] | Rilanit G 16 | 151Z7P1317 | NJCOL 160BR | Guerbitol 16 | AI3-19964 | NSC 2399 | A877978 | NJCOL 160BRA | MFCD00060903 | F11131 | NJCOL 160 | .alpha.-chloralose | CAS-2425-77-6 | EC 219-370-1 | SY034340 | AKOS015912415 | Guerbet C16 |

Storage

Room temperature

Shipped In

Normal

Overview

2-Hexyl-1-decanol is a branched alcohol. It is one of the constituent of the essential oil, extracted from the roots of Adiantum flabellulatum. It is a long-chain glass forming monohydroxy alcohol and its dielectric relaxation at low temperature has been studied.

Specifications

Synonyms

HEXYLDECANOL [INCI] | Rilanit G 16 | 151Z7P1317 | NJCOL 160BR | Guerbitol 16 | AI3-19964 | NSC 2399 | A877978 | NJCOL 160BRA | MFCD00060903 | F11131 | NJCOL 160 | .alpha.-chloralose | CAS-2425-77-6 | EC 219-370-1 | SY034340 | AKOS015912415 | Guerbet C16 |

Specifications & Purity

≥97%

Application

2-Hexyl-1-decanol may be employed as an organic solvent to study the extraction of non-polar acidic drugs from human plasma by parallel artificial liquid membrane extraction (PALME).

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Product Line

H138544-5ml

Names and Identifiers

Pubchem Sid

504756263

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504756263

Canonical Smiles

CCCCCCCCC(CCCCCC)CO

IUPAC Name

2-hexyldecan-1-ol

InChIKey

XULHFMYCBKQGEE-UHFFFAOYSA-N

INCHI

1S/C16H34O/c1-3-5-7-9-10-12-14-16(15-17)13-11-8-6-4-2/h16-17H,3-15H2,1-2H3

Isomeric SMILES

CCCCCCCCC(CCCCCC)CO

Molecular Weight

242.44

Reaxy-Rn

1748375

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1748375&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Class Fatty Acyls
      • Subclass Fatty alcohols

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Class: Fatty Acyls
• Subclass: Fatty alcohols
• Intermediate Tree Nodes: Not available
• Direct Parent: Fatty alcohols
• Alternative Parents: Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Fatty alcohol - Organic oxygen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Alcohol - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as fatty alcohols. These are aliphatic alcohols consisting of a chain of a least six carbon atoms.
• 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: 1.449
• Flash Point(°F): 318.2 °F
• Flash Point(°C): 159 °C
• Boil Point(°C): 193-197 °C/33 mmHg
• Melt Point(°C): -21~-15°C
• Molecular Weight: 242.440 g/mol
• XLogP3: 7.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 13
• Exact Mass: 242.261 Da
• Monoisotopic Mass: 242.261 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 133.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1