3-Isopropyl-2,4,5-trimethylhexane
TL;DR: 3-Isopropyl-2,4,5-trimethylhexane (CAS 62199-85-3) is a chemical compound with molecular formula C12H26 and molecular weight 170.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,5-trimethyl-4-propan-2-ylhexane
Also Known As: 2,3,5-trimethyl-4-propan-2-ylhexane, 2,3,5-TRIMETHYL-4-ISOPROPYLHEXANE, 2,3,5-trimethyl-4-propan-2-yl-hexane, 2,3,5-Trimethyl-4-(propan-2-yl)hexane, 3-ISOPROPYL-2,4,5-TRIMETHYLHEXANE
| Molecular Formula | C12H26 |
|---|---|
| Molecular Weight | 170.20 g/mol |
| LogP | 4.2067 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 170.20345 |
| Heavy Atoms | 12 |
| Complexity | 103.20672 |
Chemical Identifiers
| CAS Number | 62199-85-3 |
|---|---|
| SMILES | CC(C)C(C)C(C(C)C)C(C)C |
Product Overview
3-Isopropyl-2,4,5-trimethylhexane (CAS 62199-85-3), with molecular formula C12H26 and molecular weight 170.20 g/mol. IUPAC: 2,3,5-trimethyl-4-propan-2-ylhexane.
Chemical Property Profile of 3-Isopropyl-2,4,5-trimethylhexane
Property Insights of 3-Isopropyl-2,4,5-trimethylhexane
The XLogP value of 4.2067 indicates that 3-Isopropyl-2,4,5-trimethylhexane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 3-Isopropyl-2,4,5-trimethylhexane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Isopropyl-2,4,5-trimethylhexane has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Isopropyl-2,4,5-trimethylhexane?
The CAS number of 3-Isopropyl-2,4,5-trimethylhexane is 62199-85-3.
What is the molecular formula of 3-Isopropyl-2,4,5-trimethylhexane?
The molecular formula of 3-Isopropyl-2,4,5-trimethylhexane is C12H26.
What is the molecular weight of 3-Isopropyl-2,4,5-trimethylhexane?
The molecular weight of 3-Isopropyl-2,4,5-trimethylhexane is 170.20 g/mol.
Where can I buy 3-Isopropyl-2,4,5-trimethylhexane?
You can request a quote for 3-Isopropyl-2,4,5-trimethylhexane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Isopropyl-2,4,5-trimethylhexane?
Yes, KEHONG BIO provides custom synthesis services for 3-Isopropyl-2,4,5-trimethylhexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.