5-Phenyldodecane
TL;DR: 5-Phenyldodecane (CAS 2719-63-3) is a chemical compound with molecular formula C18H30 and molecular weight 246.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dodecan-5-ylbenzene
Also Known As: 5-Phenyldodecane, dodecan-5-ylbenzene, Benzene, (1-butyloctyl)-, Dodecane, 5-phenyl-, (Dodecan-5-yl)benzene
| Molecular Formula | C18H30 |
|---|---|
| Molecular Weight | 246.23 g/mol |
| LogP | 7.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 10 |
| Exact Mass | 246.23476 |
| Heavy Atoms | 18 |
| Complexity | 167.0 |
| Vapor Pressure | 0.000584 [mmHg] |
Chemical Identifiers
| CAS Number | 2719-63-3 |
|---|---|
| SMILES | CCCCCCCC(CCCC)C1=CC=CC=C1 |
| InChIKey | NPAWGLOPXKCTCV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Phenyldodecane (CAS 2719-63-3), with molecular formula C18H30 and molecular weight 246.23 g/mol. IUPAC: dodecan-5-ylbenzene.
Chemical Property Profile of 5-Phenyldodecane
Property Insights of 5-Phenyldodecane
The XLogP value of 7.9 indicates that 5-Phenyldodecane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 5-Phenyldodecane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Phenyldodecane 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 5-Phenyldodecane?
The CAS number of 5-Phenyldodecane is 2719-63-3.
What is the molecular formula of 5-Phenyldodecane?
The molecular formula of 5-Phenyldodecane is C18H30.
What is the molecular weight of 5-Phenyldodecane?
The molecular weight of 5-Phenyldodecane is 246.23 g/mol.
Where can I buy 5-Phenyldodecane?
You can request a quote for 5-Phenyldodecane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Phenyldodecane?
Yes, KEHONG BIO provides custom synthesis services for 5-Phenyldodecane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.