Benzo(b)naphtho(1,2-d)thiophene, 11-methyl-
TL;DR: Benzo(b)naphtho(1,2-d)thiophene, 11-methyl- (CAS 84258-84-4) 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[2,1-b][1]benzothiole
Also Known As: Benzo(b)naphtho(1,2-d)thiophene, 11-methyl-, 11-methylbenzo[b]naphtho[1,2-d]thiophene, Benzo[b]naphtho[1,2]thiophene, 11-methyl, 11-methylnaphtho[2,1-b][1]benzothiole, Benzo[b]naphtho[1,2-d]thiophene, 11-methyl
| Molecular Formula | C17H12S |
|---|---|
| Molecular Weight | 248.07 g/mol |
| LogP | 5.9 |
| 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 | 84258-84-4 |
|---|---|
| SMILES | CC1=C2C(=CC=C1)SC3=C2C4=CC=CC=C4C=C3 |
| InChIKey | ZDMWKUISVKVZNB-UHFFFAOYSA-N |
Product Overview
Benzo(b)naphtho(1,2-d)thiophene, 11-methyl- (CAS 84258-84-4), with molecular formula C17H12S and molecular weight 248.07 g/mol. IUPAC: 11-methylnaphtho[2,1-b][1]benzothiole.
Chemical Property Profile of Benzo(b)naphtho(1,2-d)thiophene, 11-methyl-
Property Insights of Benzo(b)naphtho(1,2-d)thiophene, 11-methyl-
The XLogP value of 5.9 indicates that Benzo(b)naphtho(1,2-d)thiophene, 11-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.2 Ų, Benzo(b)naphtho(1,2-d)thiophene, 11-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(b)naphtho(1,2-d)thiophene, 11-methyl- 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 Benzo(b)naphtho(1,2-d)thiophene, 11-methyl-?
The CAS number of Benzo(b)naphtho(1,2-d)thiophene, 11-methyl- is 84258-84-4.
What is the molecular formula of Benzo(b)naphtho(1,2-d)thiophene, 11-methyl-?
The molecular formula of Benzo(b)naphtho(1,2-d)thiophene, 11-methyl- is C17H12S.
What is the molecular weight of Benzo(b)naphtho(1,2-d)thiophene, 11-methyl-?
The molecular weight of Benzo(b)naphtho(1,2-d)thiophene, 11-methyl- is 248.07 g/mol.
Where can I buy Benzo(b)naphtho(1,2-d)thiophene, 11-methyl-?
You can request a quote for Benzo(b)naphtho(1,2-d)thiophene, 11-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo(b)naphtho(1,2-d)thiophene, 11-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzo(b)naphtho(1,2-d)thiophene, 11-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.