2-Phenyltridecane
TL;DR: 2-Phenyltridecane (CAS 4534-53-6) is a chemical compound with molecular formula C19H32 and molecular weight 260.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tridecan-2-ylbenzene
Also Known As: 2-Phenyltridecane, tridecan-2-ylbenzene, Tridecane, 2-phenyl-, Benzene, (1-methyldodecyl)-, (Tridecan-2-yl)benzene
| Molecular Formula | C19H32 |
|---|---|
| Molecular Weight | 260.25 g/mol |
| LogP | 8.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 11 |
| Exact Mass | 260.2504 |
| Heavy Atoms | 19 |
| Complexity | 178.0 |
Chemical Identifiers
| CAS Number | 4534-53-6 |
|---|---|
| SMILES | CCCCCCCCCCCC(C)C1=CC=CC=C1 |
| InChIKey | FCXPVFLEDIQLLO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Phenyltridecane (CAS 4534-53-6), with molecular formula C19H32 and molecular weight 260.25 g/mol. IUPAC: tridecan-2-ylbenzene.
Chemical Property Profile of 2-Phenyltridecane
Property Insights of 2-Phenyltridecane
The XLogP value of 8.5 indicates that 2-Phenyltridecane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2-Phenyltridecane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Phenyltridecane 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 2-Phenyltridecane?
The CAS number of 2-Phenyltridecane is 4534-53-6.
What is the molecular formula of 2-Phenyltridecane?
The molecular formula of 2-Phenyltridecane is C19H32.
What is the molecular weight of 2-Phenyltridecane?
The molecular weight of 2-Phenyltridecane is 260.25 g/mol.
Where can I buy 2-Phenyltridecane?
You can request a quote for 2-Phenyltridecane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Phenyltridecane?
Yes, KEHONG BIO provides custom synthesis services for 2-Phenyltridecane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.