4-(Methylthio)benzhydrol
TL;DR: 4-(Methylthio)benzhydrol (CAS 183729-63-7) is a chemical compound with molecular formula C14H14OS and molecular weight 230.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methylsulfanylphenyl)-phenylmethanol
Also Known As: 4-(Methylthio)benzhydrol, 4-methylthiobenzhydrol, (4-(Methylthio)phenyl)(phenyl)methanol, (4-methylsulfanylphenyl)-phenylmethanol, (+-)-4-methylsulfanyl-benzhydrol
| Molecular Formula | C14H14OS |
|---|---|
| Molecular Weight | 230.08 g/mol |
| LogP | 3.4902 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 230.07654 |
| Heavy Atoms | 16 |
| Complexity | 436.05234 |
Chemical Identifiers
| CAS Number | 183729-63-7 |
|---|---|
| SMILES | CSC1=CC=C(C=C1)C(C2=CC=CC=C2)O |
Product Overview
4-(Methylthio)benzhydrol (CAS 183729-63-7), with molecular formula C14H14OS and molecular weight 230.08 g/mol. IUPAC: (4-methylsulfanylphenyl)-phenylmethanol.
Chemical Property Profile of 4-(Methylthio)benzhydrol
Property Insights of 4-(Methylthio)benzhydrol
The XLogP value of 3.4902 indicates that 4-(Methylthio)benzhydrol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.23 Ų, 4-(Methylthio)benzhydrol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Methylthio)benzhydrol has 1 hydrogen bond donor(s) and 2 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 4-(Methylthio)benzhydrol?
The CAS number of 4-(Methylthio)benzhydrol is 183729-63-7.
What is the molecular formula of 4-(Methylthio)benzhydrol?
The molecular formula of 4-(Methylthio)benzhydrol is C14H14OS.
What is the molecular weight of 4-(Methylthio)benzhydrol?
The molecular weight of 4-(Methylthio)benzhydrol is 230.08 g/mol.
Where can I buy 4-(Methylthio)benzhydrol?
You can request a quote for 4-(Methylthio)benzhydrol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Methylthio)benzhydrol?
Yes, KEHONG BIO provides custom synthesis services for 4-(Methylthio)benzhydrol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.