3-Heptadecylphenol
TL;DR: 3-Heptadecylphenol (CAS 78636-94-9) is a chemical compound with molecular formula C23H40O and molecular weight 332.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-heptadecylphenol
Also Known As: 3-heptadecylphenol, 3-heptadecyl phenol, RefChem:94005
| Molecular Formula | C23H40O |
|---|---|
| Molecular Weight | 332.31 g/mol |
| LogP | 10.5 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 16 |
| Exact Mass | 332.30792 |
| Heavy Atoms | 24 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 78636-94-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC1=CC(=CC=C1)O |
| InChIKey | UFAKFKCECWXXFP-UHFFFAOYSA-N |
Product Overview
3-Heptadecylphenol (CAS 78636-94-9), with molecular formula C23H40O and molecular weight 332.31 g/mol. IUPAC: 3-heptadecylphenol.
Chemical Property Profile of 3-Heptadecylphenol
Property Insights of 3-Heptadecylphenol
The XLogP value of 10.5 indicates that 3-Heptadecylphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 3-Heptadecylphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Heptadecylphenol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Heptadecylphenol?
The CAS number of 3-Heptadecylphenol is 78636-94-9.
What is the molecular formula of 3-Heptadecylphenol?
The molecular formula of 3-Heptadecylphenol is C23H40O.
What is the molecular weight of 3-Heptadecylphenol?
The molecular weight of 3-Heptadecylphenol is 332.31 g/mol.
Where can I buy 3-Heptadecylphenol?
You can request a quote for 3-Heptadecylphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Heptadecylphenol?
Yes, KEHONG BIO provides custom synthesis services for 3-Heptadecylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.