1-(2-Pentyl)-4-(3-pentyl)benzene
TL;DR: 1-(2-Pentyl)-4-(3-pentyl)benzene (CAS 101371-20-4) is a chemical compound with molecular formula C16H26 and molecular weight 218.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-pentan-2-yl-4-pentan-3-ylbenzene
Also Known As: 1-(2-Pentyl)-4-(3-pentyl)benzene, 1-pentan-2-yl-4-pentan-3-ylbenzene, 4-(ethylpropyl)-1-(methylbutyl)benzene, Benzene,1-(1-ethylpropyl)-4-(1-methylbutyl)-, 1-(PENTAN-2-YL)-4-(PENTAN-3-YL)BENZENE
| Molecular Formula | C16H26 |
|---|---|
| Molecular Weight | 218.20 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 6 |
| Exact Mass | 218.20345 |
| Heavy Atoms | 16 |
| Complexity | 161.0 |
Chemical Identifiers
| CAS Number | 101371-20-4 |
|---|---|
| SMILES | CCCC(C)C1=CC=C(C=C1)C(CC)CC |
| InChIKey | ZMJKPBLBOSIOHA-UHFFFAOYSA-N |
Product Overview
1-(2-Pentyl)-4-(3-pentyl)benzene (CAS 101371-20-4), with molecular formula C16H26 and molecular weight 218.20 g/mol. IUPAC: 1-pentan-2-yl-4-pentan-3-ylbenzene.
Chemical Property Profile of 1-(2-Pentyl)-4-(3-pentyl)benzene
Property Insights of 1-(2-Pentyl)-4-(3-pentyl)benzene
The XLogP value of 6.3 indicates that 1-(2-Pentyl)-4-(3-pentyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-(2-Pentyl)-4-(3-pentyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Pentyl)-4-(3-pentyl)benzene 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 1-(2-Pentyl)-4-(3-pentyl)benzene?
The CAS number of 1-(2-Pentyl)-4-(3-pentyl)benzene is 101371-20-4.
What is the molecular formula of 1-(2-Pentyl)-4-(3-pentyl)benzene?
The molecular formula of 1-(2-Pentyl)-4-(3-pentyl)benzene is C16H26.
What is the molecular weight of 1-(2-Pentyl)-4-(3-pentyl)benzene?
The molecular weight of 1-(2-Pentyl)-4-(3-pentyl)benzene is 218.20 g/mol.
Where can I buy 1-(2-Pentyl)-4-(3-pentyl)benzene?
You can request a quote for 1-(2-Pentyl)-4-(3-pentyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Pentyl)-4-(3-pentyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Pentyl)-4-(3-pentyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.