Benzo(b)thiophene, 4-methyl-
TL;DR: Benzo(b)thiophene, 4-methyl- (CAS 14315-11-8) is a chemical compound with molecular formula C9H8S and molecular weight 148.03467 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methyl-1-benzothiophene
Also Known As: 4-Methylbenzo[b]thiophene, 4-Methyl-1-benzothiophene, Isoamyl caproate, 4-methylbenzo, 4-METHYLBENZOTHIOPHENE
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H8S |
| Molecular Weight | 148.03467 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 148.03467 Da |
| Heavy Atoms | 10 |
| Complexity | 122.0 |
| SMILES | CC1=C2C=CSC2=CC=C1 |
| InChIKey | RPKWIZPGQZKQKY-UHFFFAOYSA-N |
Chemical Property Profile of Benzo(b)thiophene, 4-methyl-
Property Insights of Benzo(b)thiophene, 4-methyl-
The XLogP value of 3.3 indicates that Benzo(b)thiophene, 4-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)thiophene, 4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(b)thiophene, 4-methyl- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzo(b)thiophene, 4-methyl-?
The CAS number of Benzo(b)thiophene, 4-methyl- is 14315-11-8.
What is the molecular formula of Benzo(b)thiophene, 4-methyl-?
The molecular formula of Benzo(b)thiophene, 4-methyl- is C9H8S.
What is the molecular weight of Benzo(b)thiophene, 4-methyl-?
The molecular weight of Benzo(b)thiophene, 4-methyl- is 148.03467 g/mol.
Where can I buy Benzo(b)thiophene, 4-methyl-?
You can request a quote for Benzo(b)thiophene, 4-methyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzo(b)thiophene, 4-methyl-?
Yes, CoreyChem provides custom synthesis services for Benzo(b)thiophene, 4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.