2-苯并呋喃甲酰氯
TL;DR: 2-苯并呋喃甲酰氯 (CAS 41717-28-6) is a chemical compound with molecular formula C9H5ClO2 and molecular weight 180.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-苯并呋喃甲酰氯
1-benzofuran-2-carbonyl chloride
Also Known As: Benzofuran-2-carbonyl chloride, 1-benzofuran-2-carbonyl chloride, Coumariloyl chloride, Coumarilic acid chloride, coumarilicacidchloride
| Molecular Formula | C9H5ClO2 |
|---|---|
| Molecular Weight | 180.00 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 30.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 179.9978 |
| Heavy Atoms | 12 |
| Complexity | 193.0 |
Chemical Identifiers
| CAS Number | 41717-28-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(O2)C(=O)Cl |
| InChIKey | ZJDRDTZQVOCKPI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-苯并呋喃甲酰氯 (CAS 41717-28-6), with molecular formula C9H5ClO2 and molecular weight 180.00 g/mol. IUPAC: 1-benzofuran-2-carbonyl chloride.
Chemical Property Profile of 2-苯并呋喃甲酰氯
Property Insights of 2-苯并呋喃甲酰氯
The XLogP value of 3.4 indicates that 2-苯并呋喃甲酰氯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.2 Ų, 2-苯并呋喃甲酰氯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-苯并呋喃甲酰氯 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 2-苯并呋喃甲酰氯?
The CAS number of 2-苯并呋喃甲酰氯 is 41717-28-6.
What is the molecular formula of 2-苯并呋喃甲酰氯?
The molecular formula of 2-苯并呋喃甲酰氯 is C9H5ClO2.
What is the molecular weight of 2-苯并呋喃甲酰氯?
The molecular weight of 2-苯并呋喃甲酰氯 is 180.00 g/mol.
Where can I buy 2-苯并呋喃甲酰氯?
You can request a quote for 2-苯并呋喃甲酰氯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-苯并呋喃甲酰氯?
Yes, KEHONG BIO provides custom synthesis services for 2-苯并呋喃甲酰氯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.