1-Propanethione, 1-(4-(1,1-dimethylethyl)phenyl)-2,2-dimethyl-
TL;DR: 1-Propanethione, 1-(4-(1,1-dimethylethyl)phenyl)-2,2-dimethyl- (CAS 72194-24-2) is a chemical compound with molecular formula C15H22S and molecular weight 234.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-tert-butylphenyl)-2,2-dimethylpropane-1-thione
Also Known As: 1-(4-tert-butylphenyl)-2,2-dimethylpropane-1-thione, 1-Propanethione, 1-(4-(1,1-dimethylethyl)phenyl)-2,2-dimethyl-, 4-tert-Butyl-1(1-thioxo-2,2-dimethyl-propyl)-benzene, 1-(4-tert-Butylphenyl)-2,2-dimethyl-1-propanethione, 1-(4-tert-Butylphenyl)-2,2-dimethyl-1-propanethione #
| Molecular Formula | C15H22S |
|---|---|
| Molecular Weight | 234.14 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 32.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.14423 |
| Heavy Atoms | 16 |
| Complexity | 244.0 |
Chemical Identifiers
| CAS Number | 72194-24-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=S)C(C)(C)C |
| InChIKey | ZPRFQKNKKXHCDW-UHFFFAOYSA-N |
Product Overview
1-Propanethione, 1-(4-(1,1-dimethylethyl)phenyl)-2,2-dimethyl- (CAS 72194-24-2), with molecular formula C15H22S and molecular weight 234.14 g/mol. IUPAC: 1-(4-tert-butylphenyl)-2,2-dimethylpropane-1-thione.
Chemical Property Profile of 1-Propanethione, 1-(4-(1,1-dimethylethyl)phenyl)-2,2-dimethyl-
Property Insights of 1-Propanethione, 1-(4-(1,1-dimethylethyl)phenyl)-2,2-dimethyl-
The XLogP value of 5.3 indicates that 1-Propanethione, 1-(4-(1,1-dimethylethyl)phenyl)-2,2-dimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.1 Ų, 1-Propanethione, 1-(4-(1,1-dimethylethyl)phenyl)-2,2-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propanethione, 1-(4-(1,1-dimethylethyl)phenyl)-2,2-dimethyl- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Propanethione, 1-(4-(1,1-dimethylethyl)phenyl)-2,2-dimethyl-?
The CAS number of 1-Propanethione, 1-(4-(1,1-dimethylethyl)phenyl)-2,2-dimethyl- is 72194-24-2.
What is the molecular formula of 1-Propanethione, 1-(4-(1,1-dimethylethyl)phenyl)-2,2-dimethyl-?
The molecular formula of 1-Propanethione, 1-(4-(1,1-dimethylethyl)phenyl)-2,2-dimethyl- is C15H22S.
What is the molecular weight of 1-Propanethione, 1-(4-(1,1-dimethylethyl)phenyl)-2,2-dimethyl-?
The molecular weight of 1-Propanethione, 1-(4-(1,1-dimethylethyl)phenyl)-2,2-dimethyl- is 234.14 g/mol.
Where can I buy 1-Propanethione, 1-(4-(1,1-dimethylethyl)phenyl)-2,2-dimethyl-?
You can request a quote for 1-Propanethione, 1-(4-(1,1-dimethylethyl)phenyl)-2,2-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propanethione, 1-(4-(1,1-dimethylethyl)phenyl)-2,2-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1-Propanethione, 1-(4-(1,1-dimethylethyl)phenyl)-2,2-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.