5-正十五烷基间苯二酚
TL;DR: 5-正十五烷基间苯二酚 (CAS 3158-56-3) is a chemical compound with molecular formula C21H36O2 and molecular weight 320.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-正十五烷基间苯二酚
5-pentadecylbenzene-1,3-diol
Also Known As: 5-Pentadecylresorcinol, Adipostatin A, Cardol, 5-pentadecylbenzene-1,3-diol, Resorcinol, pentadecyl-
| Molecular Formula | C21H36O2 |
|---|---|
| Molecular Weight | 320.27 g/mol |
| LogP | 9.0 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 14 |
| Exact Mass | 320.27155 |
| Heavy Atoms | 23 |
| Complexity | 244.0 |
| Melting Point | 95.5 - 96 °C |
Chemical Identifiers
| CAS Number | 3158-56-3 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC1=CC(=CC(=C1)O)O |
| InChIKey | KVVSCMOUFCNCGX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-正十五烷基间苯二酚 (CAS 3158-56-3), with molecular formula C21H36O2 and molecular weight 320.27 g/mol. IUPAC: 5-pentadecylbenzene-1,3-diol.
Chemical Property Profile of 5-正十五烷基间苯二酚
Property Insights of 5-正十五烷基间苯二酚
The XLogP value of 9.0 indicates that 5-正十五烷基间苯二酚 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 5-正十五烷基间苯二酚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-正十五烷基间苯二酚 has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-正十五烷基间苯二酚?
The CAS number of 5-正十五烷基间苯二酚 is 3158-56-3.
What is the molecular formula of 5-正十五烷基间苯二酚?
The molecular formula of 5-正十五烷基间苯二酚 is C21H36O2.
What is the molecular weight of 5-正十五烷基间苯二酚?
The molecular weight of 5-正十五烷基间苯二酚 is 320.27 g/mol.
Where can I buy 5-正十五烷基间苯二酚?
You can request a quote for 5-正十五烷基间苯二酚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-正十五烷基间苯二酚?
Yes, KEHONG BIO provides custom synthesis services for 5-正十五烷基间苯二酚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.