Benzene, 1,3-bis(1,1-dimethylpropyl)-
TL;DR: Benzene, 1,3-bis(1,1-dimethylpropyl)- (CAS 3370-27-2) 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.
1,3-bis(2-methylbutan-2-yl)benzene
Also Known As: m-Di-tert-pentylbenzene, m-Di-tert-amylbenzene, 1,3-di-tert-pentylbenzene, Benzene, 1,3-bis(1,1-dimethylpropyl)-, 1,3-bis(2-methylbutan-2-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 | 4 |
| Exact Mass | 218.20345 |
| Heavy Atoms | 16 |
| Complexity | 190.0 |
Chemical Identifiers
| CAS Number | 3370-27-2 |
|---|---|
| SMILES | CCC(C)(C)C1=CC(=CC=C1)C(C)(C)CC |
| InChIKey | VMFPJVIZINYTRD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzene, 1,3-bis(1,1-dimethylpropyl)- (CAS 3370-27-2), with molecular formula C16H26 and molecular weight 218.20 g/mol. IUPAC: 1,3-bis(2-methylbutan-2-yl)benzene.
Chemical Property Profile of Benzene, 1,3-bis(1,1-dimethylpropyl)-
Property Insights of Benzene, 1,3-bis(1,1-dimethylpropyl)-
The XLogP value of 6.3 indicates that Benzene, 1,3-bis(1,1-dimethylpropyl)- 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, 1,3-bis(1,1-dimethylpropyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1,3-bis(1,1-dimethylpropyl)- 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, 1,3-bis(1,1-dimethylpropyl)-?
The CAS number of Benzene, 1,3-bis(1,1-dimethylpropyl)- is 3370-27-2.
What is the molecular formula of Benzene, 1,3-bis(1,1-dimethylpropyl)-?
The molecular formula of Benzene, 1,3-bis(1,1-dimethylpropyl)- is C16H26.
What is the molecular weight of Benzene, 1,3-bis(1,1-dimethylpropyl)-?
The molecular weight of Benzene, 1,3-bis(1,1-dimethylpropyl)- is 218.20 g/mol.
Where can I buy Benzene, 1,3-bis(1,1-dimethylpropyl)-?
You can request a quote for Benzene, 1,3-bis(1,1-dimethylpropyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1,3-bis(1,1-dimethylpropyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1,3-bis(1,1-dimethylpropyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.