1-Pentadecanol - ≥96% , CAS No.629-76-5

CAS: 629-76-5 Cat. No.: P106565 Molecular Weight: 228.41 Beilstein Registry Number: 1700695 EC Number: 211-107-9

GRADE & PURITY ≥96%

Synonyms

DTXCID207270 | H10901 | Tox21_300553 | Alfol 15 | DTXSID0027270 | InChI=1/C15H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h16H,2-15H2,1H | NCGC00164169-01 | n-Pentadecanol | P0036 | SCHEMBL29548 | NCGC00164169-03 | Pentadecanol | 1-PENTADECANOL | 1991DA79

Storage

Room temperature

Shipped In

Normal

Application

Drug Delivery, Surface Modification, PEGylation of Protein, Peptide & Oligo

Overview

1-Pentadecanol is a linear alcohol. Vapor-phase composition of 1-pentadecanol in supercritical carbon dioxide at 323.15K has been evaluated by a flow-type apparatus.Molar heat capacities of 1-pentadecanol has been evaluated between 300K and 370K.
1-Pentadecanol may be employed as starting reagent for the asymmetric synthesis of jaspine B.

Specifications

Synonyms

DTXCID207270 | H10901 | Tox21_300553 | Alfol 15 | DTXSID0027270 | InChI=1/C15H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h16H, 2-15H2, 1H | NCGC00164169-01 | n-Pentadecanol | P0036 | SCHEMBL29548 | NCGC00164169-03 | Pentadecanol | 1-PENTADECANOL | 1991DA79

Specifications & Purity

≥96%

Storage

Room temperature

Shipped In

Normal

Purity

≥96%

Names and Identifiers

• Pubchem Sid: 488181655
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488181655
• Canonical Smiles: CCCCCCCCCCCCCCCO
• IUPAC Name: pentadecan-1-ol
• InChIKey: REIUXOLGHVXAEO-UHFFFAOYSA-N
• INCHI: 1S/C15H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h16H,2-15H2,1H3
• Isomeric SMILES: CCCCCCCCCCCCCCCO
• WGK Germany: 3
• Molecular Weight: 228.41
• Beilstein: 1700695
• Reaxy-Rn: 1700695
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1700695&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: Long-chain fatty alcohols
• Alternative Parents: Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Long chain 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 long-chain fatty alcohols. These are fatty alcohols that have an aliphatic tail of 13 to 21 carbon atoms.
• External Descriptors: a small molecule

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

Associated Targets(non-human)

Staphylococcus aureus (210822 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Solubility: Insoluble in water.
• Flash Point(°F): 233.6 °F
• Flash Point(°C): 112 °C
• Boil Point(°C): 269-271℃
• Melt Point(°C): 43-46℃
• Molecular Weight: 228.410 g/mol
• XLogP3: 6.800
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 13
• Exact Mass: 228.245 Da
• Monoisotopic Mass: 228.245 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 112.000
• 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

References

1. Qimeng Wu, Zhixue Zhang, Yao Li, Yuan Gu, Xiaokang Ding, Hao Hu, Fu-Jian Xu.  (2024)  Prussian Blue-Assisted NIR Triggered in-Situ Polymerized Nanocomposite Hydrogel for Wound Repair.  CHEMBIOCHEM,      [PMID:38925610] [10.1002/cbic.202400334]

2. Yu Han, Guohua Ma, Kai Zhang, Runcai Xu, Ning Xin, Jingtong An, Ning Wang, Yantao Li.  (2026)  Zn(II)-adjuvanted imidazole-based lipid nanoparticles for potent spleen-targeted mRNA delivery and enhanced immune activation.  JOURNAL OF CONTROLLED RELEASE,      [PMID:41720271] [10.1016/j.jconrel.2026.114742]