Benzo(b)naphtho(2,3-d)thiophene
TL;DR: Benzo(b)naphtho(2,3-d)thiophene (CAS 243-46-9) is a chemical compound with molecular formula C16H10S and molecular weight 234.05032 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
naphtho[2,3-b][1]benzothiole
Also Known As: Benzo[b]naphtho[2,3-d]thiophene, Benzonaphthothiophene, naphtho[2,3-b][1]benzothiole, BENZO(B)NAPHTHO(2,3-D)THIOPHENE, BCR136R_FLUKA
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C16H10S |
| Molecular Weight | 234.05032 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 234.05032 Da |
| Heavy Atoms | 17 |
| Complexity | 287.0 |
| Vapor Pressure | 0.0000009 [mmHg] |
| SMILES | C1=CC=C2C=C3C(=CC2=C1)C4=CC=CC=C4S3 |
| InChIKey | UWMISBRPSJFHIR-UHFFFAOYSA-N |
Product Description
Applications: Benzo(b)naphtho(2,3-d)thiophene is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Benzo(b)naphtho(2,3-d)thiophene is a heterocyclic building block identified by CAS number 243-46-9 and the molecular formula C16H10S and a molecular weight of 234.05 g/mol. Synonyms include Benzo[b]naphtho[2,3-d]thiophene and Benzonaphthothiophene.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Benzo(b)naphtho(2,3-d)thiophene
Property Insights of Benzo(b)naphtho(2,3-d)thiophene
The XLogP value of 5.2 indicates that Benzo(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, Benzo(b)naphtho(2,3-d)thiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(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
What is the CAS number of Benzo(b)naphtho(2,3-d)thiophene?
The CAS number of Benzo(b)naphtho(2,3-d)thiophene is 243-46-9.
What is the molecular formula of Benzo(b)naphtho(2,3-d)thiophene?
The molecular formula of Benzo(b)naphtho(2,3-d)thiophene is C16H10S.
What is the molecular weight of Benzo(b)naphtho(2,3-d)thiophene?
The molecular weight of Benzo(b)naphtho(2,3-d)thiophene is 234.05032 g/mol.
What are the applications of Benzo(b)naphtho(2,3-d)thiophene?
Benzo(b)naphtho(2,3-d)thiophene is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog...
Where can I buy Benzo(b)naphtho(2,3-d)thiophene?
You can request a quote for Benzo(b)naphtho(2,3-d)thiophene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzo(b)naphtho(2,3-d)thiophene?
Yes, CoreyChem provides custom synthesis services for Benzo(b)naphtho(2,3-d)thiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.