(3,4-Dichloro-1-benzothien-2-yl)methanol
TL;DR: (3,4-Dichloro-1-benzothien-2-yl)methanol (CAS 337469-52-0) is a chemical compound with molecular formula C9H6Cl2OS and molecular weight 231.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4-dichloro-1-benzothiophen-2-yl)methanol
Also Known As: (3,4-dichloro-1-benzothien-2-yl)methanol, (3,4-dichloro-1-benzothiophen-2-yl)methanol, AA-516/12432340
| Molecular Formula | C9H6Cl2OS |
|---|---|
| Molecular Weight | 231.95 g/mol |
| LogP | 3.7004 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 231.95164 |
| Heavy Atoms | 13 |
| Complexity | 450.05658 |
Chemical Identifiers
| CAS Number | 337469-52-0 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)Cl)C(=C(S2)CO)Cl |
Product Overview
(3,4-Dichloro-1-benzothien-2-yl)methanol (CAS 337469-52-0), with molecular formula C9H6Cl2OS and molecular weight 231.95 g/mol. IUPAC: (3,4-dichloro-1-benzothiophen-2-yl)methanol.
Chemical Property Profile of (3,4-Dichloro-1-benzothien-2-yl)methanol
Property Insights of (3,4-Dichloro-1-benzothien-2-yl)methanol
The XLogP value of 3.7004 indicates that (3,4-Dichloro-1-benzothien-2-yl)methanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.23 Ų, (3,4-Dichloro-1-benzothien-2-yl)methanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3,4-Dichloro-1-benzothien-2-yl)methanol 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 (3,4-Dichloro-1-benzothien-2-yl)methanol?
The CAS number of (3,4-Dichloro-1-benzothien-2-yl)methanol is 337469-52-0.
What is the molecular formula of (3,4-Dichloro-1-benzothien-2-yl)methanol?
The molecular formula of (3,4-Dichloro-1-benzothien-2-yl)methanol is C9H6Cl2OS.
What is the molecular weight of (3,4-Dichloro-1-benzothien-2-yl)methanol?
The molecular weight of (3,4-Dichloro-1-benzothien-2-yl)methanol is 231.95 g/mol.
Where can I buy (3,4-Dichloro-1-benzothien-2-yl)methanol?
You can request a quote for (3,4-Dichloro-1-benzothien-2-yl)methanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,4-Dichloro-1-benzothien-2-yl)methanol?
Yes, KEHONG BIO provides custom synthesis services for (3,4-Dichloro-1-benzothien-2-yl)methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.