1,3-Cyclopentadiene,1,3-bis(1,1-dimethylethyl)-
TL;DR: 1,3-Cyclopentadiene,1,3-bis(1,1-dimethylethyl)- (CAS 34671-24-4) is a chemical compound with molecular formula C13H22 and molecular weight 178.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-ditert-butylcyclopenta-1,3-diene
Also Known As: 1,3-ditert-butylcyclopenta-1,3-diene, 1,3-Cyclopentadiene,1,3-bis(1,1-dimethylethyl)-, 1,3-di-t-butylcyclopentadiene, 1,3-di-tert-butylcyclopentadiene, 1,3-Di(tert-butyl)cyclopentadiene
| Molecular Formula | C13H22 |
|---|---|
| Molecular Weight | 178.17 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 178.17215 |
| Heavy Atoms | 13 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 34671-24-4 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=CC1)C(C)(C)C |
| InChIKey | YDQHBVMPIFXJPJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Cyclopentadiene,1,3-bis(1,1-dimethylethyl)- (CAS 34671-24-4), with molecular formula C13H22 and molecular weight 178.17 g/mol. IUPAC: 1,3-ditert-butylcyclopenta-1,3-diene.
Chemical Property Profile of 1,3-Cyclopentadiene,1,3-bis(1,1-dimethylethyl)-
Property Insights of 1,3-Cyclopentadiene,1,3-bis(1,1-dimethylethyl)-
The XLogP value of 4.3 indicates that 1,3-Cyclopentadiene,1,3-bis(1,1-dimethylethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,3-Cyclopentadiene,1,3-bis(1,1-dimethylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Cyclopentadiene,1,3-bis(1,1-dimethylethyl)- 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 1,3-Cyclopentadiene,1,3-bis(1,1-dimethylethyl)-?
The CAS number of 1,3-Cyclopentadiene,1,3-bis(1,1-dimethylethyl)- is 34671-24-4.
What is the molecular formula of 1,3-Cyclopentadiene,1,3-bis(1,1-dimethylethyl)-?
The molecular formula of 1,3-Cyclopentadiene,1,3-bis(1,1-dimethylethyl)- is C13H22.
What is the molecular weight of 1,3-Cyclopentadiene,1,3-bis(1,1-dimethylethyl)-?
The molecular weight of 1,3-Cyclopentadiene,1,3-bis(1,1-dimethylethyl)- is 178.17 g/mol.
Where can I buy 1,3-Cyclopentadiene,1,3-bis(1,1-dimethylethyl)-?
You can request a quote for 1,3-Cyclopentadiene,1,3-bis(1,1-dimethylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Cyclopentadiene,1,3-bis(1,1-dimethylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Cyclopentadiene,1,3-bis(1,1-dimethylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.