Pentadecylbenzene
TL;DR: Pentadecylbenzene (CAS 2131-18-2) is a chemical compound with molecular formula C21H36 and molecular weight 288.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentadecylbenzene
Also Known As: Pentadecylbenzene, 1-Phenylpentadecane, Benzene, pentadecyl-, N-PENTADECYLBENZENE, Pentadecylcyclohexane
| Molecular Formula | C21H36 |
|---|---|
| Molecular Weight | 288.28 g/mol |
| LogP | 10.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 14 |
| Exact Mass | 288.2817 |
| Heavy Atoms | 21 |
| Complexity | 190.0 |
| Melting Point | 22 °C |
| Boiling Point | 373 °C |
| Density | 0.8548 @ 20 °C |
| Vapor Pressure | 0.0000072 [mmHg] |
| Refractive Index | 1.4815 @ 20 °C |
Chemical Identifiers
| CAS Number | 2131-18-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC1=CC=CC=C1 |
| InChIKey | JIRNEODMTPGRGV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pentadecylbenzene (CAS 2131-18-2), with molecular formula C21H36 and molecular weight 288.28 g/mol. IUPAC: pentadecylbenzene.
Chemical Property Profile of Pentadecylbenzene
Property Insights of Pentadecylbenzene
The XLogP value of 10.4 indicates that Pentadecylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Pentadecylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentadecylbenzene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pentadecylbenzene?
The CAS number of Pentadecylbenzene is 2131-18-2.
What is the molecular formula of Pentadecylbenzene?
The molecular formula of Pentadecylbenzene is C21H36.
What is the molecular weight of Pentadecylbenzene?
The molecular weight of Pentadecylbenzene is 288.28 g/mol.
Where can I buy Pentadecylbenzene?
You can request a quote for Pentadecylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentadecylbenzene?
Yes, KEHONG BIO provides custom synthesis services for Pentadecylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.