2-Bromo-4,5-dihydro-3H-naphtho[1,8-bc]thiophen-5-ol
TL;DR: 2-Bromo-4,5-dihydro-3H-naphtho[1,8-bc]thiophen-5-ol (CAS 10245-75-7) is a chemical compound with molecular formula C11H9BrOS and molecular weight 267.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-2-thiatricyclo[6.3.1.04,12]dodeca-1(11),3,8(12),9-tetraen-7-ol
Also Known As: 2-Bromo-4,5-dihydro-3H-naphtho[1,8-bc]thiophen-5-ol, 3H-Naphtho[1,8-bc]thiophene-5-ol, 2-bromo-4,5-dihydro-, 3-bromo-2-thiatricyclo[6.3.1.04,12]dodeca-1(11),3,8(12),9-tetraen-7-ol, 2-Bromo-4,5-dihydro-3H-naphtho[1,8-bc]thiophen-5-ol #
| Molecular Formula | C11H9BrOS |
|---|---|
| Molecular Weight | 267.96 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 48.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 267.95575 |
| Heavy Atoms | 14 |
| Complexity | 235.0 |
Chemical Identifiers
| CAS Number | 10245-75-7 |
|---|---|
| SMILES | C1CC2=C(SC3=CC=CC(=C23)C1O)Br |
| InChIKey | SBAKMCKCKJSGCW-UHFFFAOYSA-N |
Product Overview
2-Bromo-4,5-dihydro-3H-naphtho[1,8-bc]thiophen-5-ol (CAS 10245-75-7), with molecular formula C11H9BrOS and molecular weight 267.96 g/mol. IUPAC: 3-bromo-2-thiatricyclo[6.3.1.04,12]dodeca-1(11),3,8(12),9-tetraen-7-ol.
Chemical Property Profile of 2-Bromo-4,5-dihydro-3H-naphtho[1,8-bc]thiophen-5-ol
Property Insights of 2-Bromo-4,5-dihydro-3H-naphtho[1,8-bc]thiophen-5-ol
The XLogP value of 3.5 indicates that 2-Bromo-4,5-dihydro-3H-naphtho[1,8-bc]thiophen-5-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.5 Ų, 2-Bromo-4,5-dihydro-3H-naphtho[1,8-bc]thiophen-5-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-4,5-dihydro-3H-naphtho[1,8-bc]thiophen-5-ol 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 2-Bromo-4,5-dihydro-3H-naphtho[1,8-bc]thiophen-5-ol?
The CAS number of 2-Bromo-4,5-dihydro-3H-naphtho[1,8-bc]thiophen-5-ol is 10245-75-7.
What is the molecular formula of 2-Bromo-4,5-dihydro-3H-naphtho[1,8-bc]thiophen-5-ol?
The molecular formula of 2-Bromo-4,5-dihydro-3H-naphtho[1,8-bc]thiophen-5-ol is C11H9BrOS.
What is the molecular weight of 2-Bromo-4,5-dihydro-3H-naphtho[1,8-bc]thiophen-5-ol?
The molecular weight of 2-Bromo-4,5-dihydro-3H-naphtho[1,8-bc]thiophen-5-ol is 267.96 g/mol.
Where can I buy 2-Bromo-4,5-dihydro-3H-naphtho[1,8-bc]thiophen-5-ol?
You can request a quote for 2-Bromo-4,5-dihydro-3H-naphtho[1,8-bc]thiophen-5-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-4,5-dihydro-3H-naphtho[1,8-bc]thiophen-5-ol?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-4,5-dihydro-3H-naphtho[1,8-bc]thiophen-5-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.