5-Nitro-1-benzothiophene-2-carbonyl chloride
TL;DR: 5-Nitro-1-benzothiophene-2-carbonyl chloride (CAS 86010-32-4) is a chemical compound with molecular formula C9H4ClNO3S and molecular weight 240.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitro-1-benzothiophene-2-carbonyl chloride
Also Known As: 5-nitro-1-benzothiophene-2-carbonyl chloride, 5-nitrobenzo[b]thiophene-2-carbonyl chloride, 5-nitrobenzothiophene-2-carbonyl chloride, 5-nitrobenzobthiophene-2-carbonyl chloride, 5-Nitrobenzothiophene-2-carboxoyl Chloride
| Molecular Formula | C9H4ClNO3S |
|---|---|
| Molecular Weight | 240.96 g/mol |
| LogP | 3.1885 |
| Topological Polar Surface Area | 60.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.96004 |
| Heavy Atoms | 15 |
| Complexity | 551.48285 |
Chemical Identifiers
| CAS Number | 86010-32-4 |
|---|---|
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])C=C(S2)C(=O)Cl |
Product Overview
5-Nitro-1-benzothiophene-2-carbonyl chloride (CAS 86010-32-4), with molecular formula C9H4ClNO3S and molecular weight 240.96 g/mol. IUPAC: 5-nitro-1-benzothiophene-2-carbonyl chloride.
Chemical Property Profile of 5-Nitro-1-benzothiophene-2-carbonyl chloride
Property Insights of 5-Nitro-1-benzothiophene-2-carbonyl chloride
The XLogP value of 3.1885 indicates that 5-Nitro-1-benzothiophene-2-carbonyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Nitro-1-benzothiophene-2-carbonyl chloride. Following Lipinski's Rule of Five, 5-Nitro-1-benzothiophene-2-carbonyl chloride has 0 hydrogen bond donor(s) and 4 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 5-Nitro-1-benzothiophene-2-carbonyl chloride?
The CAS number of 5-Nitro-1-benzothiophene-2-carbonyl chloride is 86010-32-4.
What is the molecular formula of 5-Nitro-1-benzothiophene-2-carbonyl chloride?
The molecular formula of 5-Nitro-1-benzothiophene-2-carbonyl chloride is C9H4ClNO3S.
What is the molecular weight of 5-Nitro-1-benzothiophene-2-carbonyl chloride?
The molecular weight of 5-Nitro-1-benzothiophene-2-carbonyl chloride is 240.96 g/mol.
Where can I buy 5-Nitro-1-benzothiophene-2-carbonyl chloride?
You can request a quote for 5-Nitro-1-benzothiophene-2-carbonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Nitro-1-benzothiophene-2-carbonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 5-Nitro-1-benzothiophene-2-carbonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.