N-(2-氯乙基)邻苯二甲酰亚胺
TL;DR: N-(2-氯乙基)邻苯二甲酰亚胺 (CAS 946680-84-8) is a chemical compound with molecular formula C10H8ClNO2 and molecular weight 209.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-氯乙基)邻苯二甲酰亚胺
2-(2-chloroethyl)isoindole-1,3-dione
Also Known As: N-(2-Chloroethyl)phthalimide, 2-(2-chloroethyl)isoindoline-1,3-dione, Cinnoxicam, 2-(2-chloroethyl)-1H-isoindole-1,3(2H)-dione, 2-(2-chloroethyl)isoindole-1,3-dione
| Molecular Formula | C10H8ClNO2 |
|---|---|
| Molecular Weight | 209.02 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 209.02435 |
| Heavy Atoms | 14 |
| Complexity | 243.0 |
Chemical Identifiers
| CAS Number | 946680-84-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CCCl |
| InChIKey | ZPHGARLYQHMNTB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(2-氯乙基)邻苯二甲酰亚胺 (CAS 946680-84-8), with molecular formula C10H8ClNO2 and molecular weight 209.02 g/mol. IUPAC: 2-(2-chloroethyl)isoindole-1,3-dione.
Chemical Property Profile of N-(2-氯乙基)邻苯二甲酰亚胺
Property Insights of N-(2-氯乙基)邻苯二甲酰亚胺
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-氯乙基)邻苯二甲酰亚胺. With a topological polar surface area (TPSA) of 37.4 Ų, N-(2-氯乙基)邻苯二甲酰亚胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-氯乙基)邻苯二甲酰亚胺 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 N-(2-氯乙基)邻苯二甲酰亚胺?
The CAS number of N-(2-氯乙基)邻苯二甲酰亚胺 is 946680-84-8.
What is the molecular formula of N-(2-氯乙基)邻苯二甲酰亚胺?
The molecular formula of N-(2-氯乙基)邻苯二甲酰亚胺 is C10H8ClNO2.
What is the molecular weight of N-(2-氯乙基)邻苯二甲酰亚胺?
The molecular weight of N-(2-氯乙基)邻苯二甲酰亚胺 is 209.02 g/mol.
Where can I buy N-(2-氯乙基)邻苯二甲酰亚胺?
You can request a quote for N-(2-氯乙基)邻苯二甲酰亚胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-氯乙基)邻苯二甲酰亚胺?
Yes, KEHONG BIO provides custom synthesis services for N-(2-氯乙基)邻苯二甲酰亚胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.