![Phenol, 2,6-bis(1,1-dimethylethyl)-4-[3-[(phenylmethyl)thio]propyl]- structure](/static/products/5269/52696-94-3.webp)
Phenol, 2,6-bis(1,1-dimethylethyl)-4-[3-[(phenylmethyl)thio]propyl]-
TL;DR: Phenol, 2,6-bis(1,1-dimethylethyl)-4-[3-[(phenylmethyl)thio]propyl]- (CAS 52696-94-3) is a chemical compound with molecular formula C24H34OS and molecular weight 370.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-benzylsulfanylpropyl)-2,6-ditert-butylphenol
Also Known As: 4-(3-benzylsulfanylpropyl)-2,6-ditert-butylphenol, J2.076.058C, 2,6-Di-tert-butyl-4-[3-(benzylthio)propyl]phenol, 4-(3-benzylsulfanylpropyl)-2,6-ditert-butyl-phenol, 4-[3-(BENZYLSULFANYL)PROPYL]-2,6-DI-TERT-BUTYLPHENOL
| Molecular Formula | C24H34OS |
|---|---|
| Molecular Weight | 370.23 g/mol |
| LogP | 6.8532 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 370.23303 |
| Heavy Atoms | 26 |
| Complexity | 670.221 |
Chemical Identifiers
| CAS Number | 52696-94-3 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCSCC2=CC=CC=C2 |
Product Overview
Phenol, 2,6-bis(1,1-dimethylethyl)-4-[3-[(phenylmethyl)thio]propyl]- (CAS 52696-94-3), with molecular formula C24H34OS and molecular weight 370.23 g/mol. IUPAC: 4-(3-benzylsulfanylpropyl)-2,6-ditert-butylphenol.
Chemical Property Profile of Phenol, 2,6-bis(1,1-dimethylethyl)-4-[3-[(phenylmethyl)thio]propyl]-
Property Insights of Phenol, 2,6-bis(1,1-dimethylethyl)-4-[3-[(phenylmethyl)thio]propyl]-
The XLogP value of 6.8532 indicates that Phenol, 2,6-bis(1,1-dimethylethyl)-4-[3-[(phenylmethyl)thio]propyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.23 Ų, Phenol, 2,6-bis(1,1-dimethylethyl)-4-[3-[(phenylmethyl)thio]propyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 2,6-bis(1,1-dimethylethyl)-4-[3-[(phenylmethyl)thio]propyl]- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phenol, 2,6-bis(1,1-dimethylethyl)-4-[3-[(phenylmethyl)thio]propyl]-?
The CAS number of Phenol, 2,6-bis(1,1-dimethylethyl)-4-[3-[(phenylmethyl)thio]propyl]- is 52696-94-3.
What is the molecular formula of Phenol, 2,6-bis(1,1-dimethylethyl)-4-[3-[(phenylmethyl)thio]propyl]-?
The molecular formula of Phenol, 2,6-bis(1,1-dimethylethyl)-4-[3-[(phenylmethyl)thio]propyl]- is C24H34OS.
What is the molecular weight of Phenol, 2,6-bis(1,1-dimethylethyl)-4-[3-[(phenylmethyl)thio]propyl]-?
The molecular weight of Phenol, 2,6-bis(1,1-dimethylethyl)-4-[3-[(phenylmethyl)thio]propyl]- is 370.23 g/mol.
Where can I buy Phenol, 2,6-bis(1,1-dimethylethyl)-4-[3-[(phenylmethyl)thio]propyl]-?
You can request a quote for Phenol, 2,6-bis(1,1-dimethylethyl)-4-[3-[(phenylmethyl)thio]propyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 2,6-bis(1,1-dimethylethyl)-4-[3-[(phenylmethyl)thio]propyl]-?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 2,6-bis(1,1-dimethylethyl)-4-[3-[(phenylmethyl)thio]propyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.