Lanolin - USP , CAS No.8006-54-0

CAS: 8006-54-0 Cat. No.: L116309 EC Number: 232-348-6

GRADE & PURITY USP

Synonyms

Stearyl palmitate, >=99% | Unat | Lanolin anhydrous | BAY-g 5421 | 3,5-Heptanedione, 4-(6-(2-chloro-4-methoxyphenoxy)hexyl)- | EINECS 309-376-3 | AI3-30713 | AKOS028115046 | Q27157447 | EINECS 220-000-6 | Octadecyl hexadecanoate | PALMITIC ACID, STEARYL E

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

Stearyl palmitate, >=99% | Unat | Lanolin anhydrous | BAY-g 5421 | 3,5-Heptanedione, 4-(6-(2-chloro-4-methoxyphenoxy)hexyl)- | EINECS 309-376-3 | AI3-30713 | AKOS028115046 | Q27157447 | EINECS 220-000-6 | Octadecyl hexadecanoate | PALMITIC ACID, STEARYL E

Specifications & Purity

USP

Biochemical and Physiological Mechanisms

Lanolin is a complex waxy substance composed of varying quantities of long-chain waxy esters and lanolin alcohols, acids and polycarbons. Lanolin is used in a wide variety of creams, ointments and emollients. Lanolin is often studied to determine it aller

Storage

Room temperature

Shipped In

Normal

Grade

USP

Names and Identifiers

Pubchem Sid

488185163

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488185163

Canonical Smiles

CCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCC

IUPAC Name

octadecyl hexadecanoate

InChIKey

BILPUZXRUDPOOF-UHFFFAOYSA-N

INCHI

1S/C34H68O2/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-33-36-34(35)32-30-28-26-24-22-20-16-14-12-10-8-6-4-2/h3-33H2,1-2H3

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCC

WGK Germany

1

RTECS

OE3201000

Reaxy-Rn

1806384

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1806384&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Class Fatty Acyls
      • Subclass Fatty acid esters
        • Level5 Wax esters
          • Level6 Wax monoesters

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Class: Fatty Acyls
• Subclass: Fatty acid esters
• Intermediate Tree Nodes: Wax esters
• Direct Parent: Wax monoesters
• Alternative Parents: Fatty alcohol esters Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Wax monoester skeleton - Fatty alcohol ester - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as wax monoesters. These are waxes bearing an ester group at exactly one position.
• External Descriptors: Wax monoesters

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: Soluble in ether, petroleum ether, chloroform and petroleum benzene. Sparingly soluble in ethanol. Insoluble in water.
• Flash Point(°F): >110℃
• Flash Point(°C): >110℃
• Melt Point(°C): 38-42°C
• Molecular Weight: 508.900 g/mol
• XLogP3: 16.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 32
• Exact Mass: 508.522 Da
• Monoisotopic Mass: 508.522 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 36
• Formal Charge: 0
• Complexity: 406.000
• 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 are the CAS number, molecular formula and molecular weight?

The CAS Number is 8006-54-0. InChIKey BILPUZXRUDPOOF-UHFFFAOYSA-N.

What does USP mean?

USP indicates that the material complies with the published monographs of the relevant pharmacopoeia (USP). Specifications include identity, assay, impurity limits, residual solvents and other tests defined in the monograph. USP-compliant material is suitable for pharmacopoeia-compliant pharmaceutical use, including pharmaceutical manufacturing, QC and regulatory submission.

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 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.