1-Benzothiophene-5-carbonyl chloride
TL;DR: 1-Benzothiophene-5-carbonyl chloride (CAS 1128-89-8) is a chemical compound with molecular formula C9H5ClOS and molecular weight 195.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzothiophene-5-carbonyl chloride
Also Known As: 1-benzothiophene-5-carbonyl chloride, Benzo[b]thiophene-5-carbonylchloride, benzo[b]thiophene-5-carbonyl chloride, 1-Benzothiophene-5-carbonylchloride, benzothiophene-5-carbonyl chloride
| Molecular Formula | C9H5ClOS |
|---|---|
| Molecular Weight | 195.97 g/mol |
| LogP | 3.2803 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 195.97496 |
| Heavy Atoms | 12 |
| Complexity | 432.7761 |
Chemical Identifiers
| CAS Number | 1128-89-8 |
|---|---|
| SMILES | C1=CC2=C(C=CS2)C=C1C(=O)Cl |
Product Overview
1-Benzothiophene-5-carbonyl chloride (CAS 1128-89-8), with molecular formula C9H5ClOS and molecular weight 195.97 g/mol. IUPAC: 1-benzothiophene-5-carbonyl chloride.
Chemical Property Profile of 1-Benzothiophene-5-carbonyl chloride
Property Insights of 1-Benzothiophene-5-carbonyl chloride
The XLogP value of 3.2803 indicates that 1-Benzothiophene-5-carbonyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 1-Benzothiophene-5-carbonyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzothiophene-5-carbonyl chloride has 0 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 1-Benzothiophene-5-carbonyl chloride?
The CAS number of 1-Benzothiophene-5-carbonyl chloride is 1128-89-8.
What is the molecular formula of 1-Benzothiophene-5-carbonyl chloride?
The molecular formula of 1-Benzothiophene-5-carbonyl chloride is C9H5ClOS.
What is the molecular weight of 1-Benzothiophene-5-carbonyl chloride?
The molecular weight of 1-Benzothiophene-5-carbonyl chloride is 195.97 g/mol.
Where can I buy 1-Benzothiophene-5-carbonyl chloride?
You can request a quote for 1-Benzothiophene-5-carbonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzothiophene-5-carbonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzothiophene-5-carbonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.