Benzene, (1,1,4,6,6-pentamethylheptyl)-
TL;DR: Benzene, (1,1,4,6,6-pentamethylheptyl)- (CAS 55134-07-1) 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.
2,5,7,7-tetramethyloctan-2-ylbenzene
Also Known As: benzene, Benzene, (1,1,4,6,6-pentamethylheptyl)-, (1,1,4,6,6-Pentamethylheptyl)benzene, 2,5,7,7-tetramethyloctan-2-ylbenzene, Benzene,(1,1,4,6,6-pentamethylheptyl)
| Molecular Formula | C18H30 |
|---|---|
| Molecular Weight | 246.23 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 6 |
| Exact Mass | 246.23476 |
| Heavy Atoms | 18 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 55134-07-1 |
|---|---|
| SMILES | CC(CCC(C)(C)C1=CC=CC=C1)CC(C)(C)C |
| InChIKey | UTXRCLGZQJOBBN-UHFFFAOYSA-N |
Product Overview
Benzene, (1,1,4,6,6-pentamethylheptyl)- (CAS 55134-07-1), with molecular formula C18H30 and molecular weight 246.23 g/mol. IUPAC: 2,5,7,7-tetramethyloctan-2-ylbenzene.
Chemical Property Profile of Benzene, (1,1,4,6,6-pentamethylheptyl)-
Property Insights of Benzene, (1,1,4,6,6-pentamethylheptyl)-
The XLogP value of 7.2 indicates that Benzene, (1,1,4,6,6-pentamethylheptyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Benzene, (1,1,4,6,6-pentamethylheptyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, (1,1,4,6,6-pentamethylheptyl)- 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 Benzene, (1,1,4,6,6-pentamethylheptyl)-?
The CAS number of Benzene, (1,1,4,6,6-pentamethylheptyl)- is 55134-07-1.
What is the molecular formula of Benzene, (1,1,4,6,6-pentamethylheptyl)-?
The molecular formula of Benzene, (1,1,4,6,6-pentamethylheptyl)- is C18H30.
What is the molecular weight of Benzene, (1,1,4,6,6-pentamethylheptyl)-?
The molecular weight of Benzene, (1,1,4,6,6-pentamethylheptyl)- is 246.23 g/mol.
Where can I buy Benzene, (1,1,4,6,6-pentamethylheptyl)-?
You can request a quote for Benzene, (1,1,4,6,6-pentamethylheptyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, (1,1,4,6,6-pentamethylheptyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, (1,1,4,6,6-pentamethylheptyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.