4,5,6,7-Tetrahydro-1-benzothien-2-ylmethanol
TL;DR: 4,5,6,7-Tetrahydro-1-benzothien-2-ylmethanol (CAS 51632-08-7) is a chemical compound with molecular formula C9H12OS and molecular weight 168.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5,6,7-tetrahydro-1-benzothiophen-2-ylmethanol
Also Known As: ChemDiv3_014722, 4,5,6,7-Tetrahydro-1-benzothien-2-ylmethanol, (4,5,6,7-Tetrahydrobenzo[b]thiophen-2-yl)methanol, (4,5,6,7-Tetrahydro-1-benzothiophen-2-yl)methanol, IDI1_030520
| Molecular Formula | C9H12OS |
|---|---|
| Molecular Weight | 168.06 g/mol |
| LogP | 2.1192 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 168.06088 |
| Heavy Atoms | 11 |
| Complexity | 228.56546 |
Chemical Identifiers
| CAS Number | 51632-08-7 |
|---|---|
| SMILES | C1CCC2=C(C1)C=C(S2)CO |
Product Overview
4,5,6,7-Tetrahydro-1-benzothien-2-ylmethanol (CAS 51632-08-7), with molecular formula C9H12OS and molecular weight 168.06 g/mol. IUPAC: 4,5,6,7-tetrahydro-1-benzothiophen-2-ylmethanol.
Chemical Property Profile of 4,5,6,7-Tetrahydro-1-benzothien-2-ylmethanol
Property Insights of 4,5,6,7-Tetrahydro-1-benzothien-2-ylmethanol
The XLogP value of 2.1192 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5,6,7-Tetrahydro-1-benzothien-2-ylmethanol. With a topological polar surface area (TPSA) of 20.23 Ų, 4,5,6,7-Tetrahydro-1-benzothien-2-ylmethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5,6,7-Tetrahydro-1-benzothien-2-ylmethanol 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 4,5,6,7-Tetrahydro-1-benzothien-2-ylmethanol?
The CAS number of 4,5,6,7-Tetrahydro-1-benzothien-2-ylmethanol is 51632-08-7.
What is the molecular formula of 4,5,6,7-Tetrahydro-1-benzothien-2-ylmethanol?
The molecular formula of 4,5,6,7-Tetrahydro-1-benzothien-2-ylmethanol is C9H12OS.
What is the molecular weight of 4,5,6,7-Tetrahydro-1-benzothien-2-ylmethanol?
The molecular weight of 4,5,6,7-Tetrahydro-1-benzothien-2-ylmethanol is 168.06 g/mol.
Where can I buy 4,5,6,7-Tetrahydro-1-benzothien-2-ylmethanol?
You can request a quote for 4,5,6,7-Tetrahydro-1-benzothien-2-ylmethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5,6,7-Tetrahydro-1-benzothien-2-ylmethanol?
Yes, KEHONG BIO provides custom synthesis services for 4,5,6,7-Tetrahydro-1-benzothien-2-ylmethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.