间茴香酰氯
TL;DR: 间茴香酰氯 (CAS 1711-05-3) is a chemical compound with molecular formula C8H7ClO2 and molecular weight 170.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
间茴香酰氯
3-methoxybenzoyl chloride
Also Known As: 3-Methoxybenzoyl chloride, m-Anisoyl chloride, 3-anisoyl chloride, m-Methoxybenzoyl chloride, Benzoyl chloride, 3-methoxy-
| Molecular Formula | C8H7ClO2 |
|---|---|
| Molecular Weight | 170.01 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.01346 |
| Heavy Atoms | 11 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 1711-05-3 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C(=O)Cl |
| InChIKey | RUQIUASLAXJZIE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
间茴香酰氯 (CAS 1711-05-3), with molecular formula C8H7ClO2 and molecular weight 170.01 g/mol. IUPAC: 3-methoxybenzoyl chloride.
Chemical Property Profile of 间茴香酰氯
Property Insights of 间茴香酰氯
The XLogP value of 3.0 indicates that 间茴香酰氯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 间茴香酰氯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 间茴香酰氯 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 间茴香酰氯?
The CAS number of 间茴香酰氯 is 1711-05-3.
What is the molecular formula of 间茴香酰氯?
The molecular formula of 间茴香酰氯 is C8H7ClO2.
What is the molecular weight of 间茴香酰氯?
The molecular weight of 间茴香酰氯 is 170.01 g/mol.
Where can I buy 间茴香酰氯?
You can request a quote for 间茴香酰氯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 间茴香酰氯?
Yes, KEHONG BIO provides custom synthesis services for 间茴香酰氯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.