Tri-t-butylmethane
TL;DR: Tri-t-butylmethane (CAS 35660-96-9) is a chemical compound with molecular formula C13H28 and molecular weight 184.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-tert-butyl-2,2,4,4-tetramethylpentane
Also Known As: Tri-t-butylmethane, 3-tert-butyl-2,2,4,4-tetramethylpentane, 2,2,4,4-Tetramethyl-3-tert-butylpentane, 2,2,4,4-Tetramethyl-3-(1,1-dimethylethyl)pentane, pentane, 3-(1,1-dimethylethyl)-2,2,4,4-tetramethyl-
| Molecular Formula | C13H28 |
|---|---|
| Molecular Weight | 184.22 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 184.2191 |
| Heavy Atoms | 13 |
| Complexity | 123.0 |
Chemical Identifiers
| CAS Number | 35660-96-9 |
|---|---|
| SMILES | CC(C)(C)C(C(C)(C)C)C(C)(C)C |
| InChIKey | LVLOQIPOJWLAEB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tri-t-butylmethane (CAS 35660-96-9), with molecular formula C13H28 and molecular weight 184.22 g/mol. IUPAC: 3-tert-butyl-2,2,4,4-tetramethylpentane.
Chemical Property Profile of Tri-t-butylmethane
Property Insights of Tri-t-butylmethane
The XLogP value of 5.7 indicates that Tri-t-butylmethane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Tri-t-butylmethane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tri-t-butylmethane 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 Tri-t-butylmethane?
The CAS number of Tri-t-butylmethane is 35660-96-9.
What is the molecular formula of Tri-t-butylmethane?
The molecular formula of Tri-t-butylmethane is C13H28.
What is the molecular weight of Tri-t-butylmethane?
The molecular weight of Tri-t-butylmethane is 184.22 g/mol.
Where can I buy Tri-t-butylmethane?
You can request a quote for Tri-t-butylmethane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tri-t-butylmethane?
Yes, KEHONG BIO provides custom synthesis services for Tri-t-butylmethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.