11-Methylbenzo(b)naphtho(2,3-d)thiophene
TL;DR: 11-Methylbenzo(b)naphtho(2,3-d)thiophene (CAS 79966-33-9) is a chemical compound with molecular formula C17H12S and molecular weight 248.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-methylnaphtho[2,3-b][1]benzothiole
Also Known As: 11-methylbenzo[b]naphtho[2,3-d]thiophene, 11-Methylbenzo(b)naphtho(2,3-d)thiophene, Benzo[b]naphtho[2,3-d]thiophene, 11-methyl, Benzo(b)naphtho(2,3-d)thiophene, 11-methyl-, Benzo[b]naphtho[2,3]thiophene, 11-methyl
| Molecular Formula | C17H12S |
|---|---|
| Molecular Weight | 248.07 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 248.06598 |
| Heavy Atoms | 18 |
| Complexity | 313.0 |
Chemical Identifiers
| CAS Number | 79966-33-9 |
|---|---|
| SMILES | CC1=C2C3=CC=CC=C3SC2=CC4=CC=CC=C14 |
| InChIKey | BXBYDPRWMFDDSH-UHFFFAOYSA-N |
Product Overview
11-Methylbenzo(b)naphtho(2,3-d)thiophene (CAS 79966-33-9), with molecular formula C17H12S and molecular weight 248.07 g/mol. IUPAC: 11-methylnaphtho[2,3-b][1]benzothiole.
Chemical Property Profile of 11-Methylbenzo(b)naphtho(2,3-d)thiophene
Property Insights of 11-Methylbenzo(b)naphtho(2,3-d)thiophene
The XLogP value of 5.6 indicates that 11-Methylbenzo(b)naphtho(2,3-d)thiophene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.2 Ų, 11-Methylbenzo(b)naphtho(2,3-d)thiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 11-Methylbenzo(b)naphtho(2,3-d)thiophene has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 11-Methylbenzo(b)naphtho(2,3-d)thiophene?
The CAS number of 11-Methylbenzo(b)naphtho(2,3-d)thiophene is 79966-33-9.
What is the molecular formula of 11-Methylbenzo(b)naphtho(2,3-d)thiophene?
The molecular formula of 11-Methylbenzo(b)naphtho(2,3-d)thiophene is C17H12S.
What is the molecular weight of 11-Methylbenzo(b)naphtho(2,3-d)thiophene?
The molecular weight of 11-Methylbenzo(b)naphtho(2,3-d)thiophene is 248.07 g/mol.
Where can I buy 11-Methylbenzo(b)naphtho(2,3-d)thiophene?
You can request a quote for 11-Methylbenzo(b)naphtho(2,3-d)thiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11-Methylbenzo(b)naphtho(2,3-d)thiophene?
Yes, KEHONG BIO provides custom synthesis services for 11-Methylbenzo(b)naphtho(2,3-d)thiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.