Thiophene, bis(1,1-dimethylethyl)-
TL;DR: Thiophene, bis(1,1-dimethylethyl)- (CAS 30140-46-6) is a chemical compound with molecular formula C36H60S3 and molecular weight 588.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-ditert-butylthiophene;2,5-ditert-butylthiophene;3,4-ditert-butylthiophene
Also Known As: Thiophene, di-tert-butyl-, Thiophene, bis(1,1-dimethylethyl)-, BIS(1,1-DIMETHYLETHYL)THIOPHENE, 2,3-ditert-butylthiophene; 2,5-ditert-butylthiophene; 3,4-ditert-butylthiophene
| Molecular Formula | C36H60S3 |
|---|---|
| Molecular Weight | 588.39 g/mol |
| LogP | 13.03 |
| Topological Polar Surface Area | 84.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 588.38574 |
| Heavy Atoms | 39 |
| Complexity | 472.0 |
Chemical Identifiers
| CAS Number | 30140-46-6 |
|---|---|
| SMILES | CC(C)(C)C1=C(SC=C1)C(C)(C)C.CC(C)(C)C1=CC=C(S1)C(C)(C)C.CC(C)(C)C1=CSC=C1C(C)(C)C |
| InChIKey | RSYKBKFUOILYBO-UHFFFAOYSA-N |
Product Overview
Thiophene, bis(1,1-dimethylethyl)- (CAS 30140-46-6), with molecular formula C36H60S3 and molecular weight 588.39 g/mol. IUPAC: 2,3-ditert-butylthiophene;2,5-ditert-butylthiophene;3,4-ditert-butylthiophene.
Chemical Property Profile of Thiophene, bis(1,1-dimethylethyl)-
Property Insights of Thiophene, bis(1,1-dimethylethyl)-
The XLogP value of 13.03 indicates that Thiophene, bis(1,1-dimethylethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Thiophene, bis(1,1-dimethylethyl)-. Following Lipinski's Rule of Five, Thiophene, bis(1,1-dimethylethyl)- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Thiophene, bis(1,1-dimethylethyl)-?
The CAS number of Thiophene, bis(1,1-dimethylethyl)- is 30140-46-6.
What is the molecular formula of Thiophene, bis(1,1-dimethylethyl)-?
The molecular formula of Thiophene, bis(1,1-dimethylethyl)- is C36H60S3.
What is the molecular weight of Thiophene, bis(1,1-dimethylethyl)-?
The molecular weight of Thiophene, bis(1,1-dimethylethyl)- is 588.39 g/mol.
Where can I buy Thiophene, bis(1,1-dimethylethyl)-?
You can request a quote for Thiophene, 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 Thiophene, bis(1,1-dimethylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Thiophene, bis(1,1-dimethylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.