1H-Pyrrole-2,5-dione, 3-chloro-4-(chloromethyl)-
TL;DR: 1H-Pyrrole-2,5-dione, 3-chloro-4-(chloromethyl)- (CAS 339152-95-3) is a chemical compound with molecular formula C5H3Cl2NO2 and molecular weight 178.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-4-(chloromethyl)pyrrole-2,5-dione
Also Known As: 3-Chloro-4-(chloromethyl)-1H-pyrrole-2,5-dione, 1H-Pyrrole-2,5-dione, 3-chloro-4-(chloromethyl)-, 3-chloro-4-(chloromethyl)pyrrole-2,5-dione
| Molecular Formula | C5H3Cl2NO2 |
|---|---|
| Molecular Weight | 178.95 g/mol |
| LogP | 0.3745 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 178.95409 |
| Heavy Atoms | 10 |
| Complexity | 233.80244 |
Chemical Identifiers
| CAS Number | 339152-95-3 |
|---|---|
| SMILES | C(C1=C(C(=O)NC1=O)Cl)Cl |
Product Overview
1H-Pyrrole-2,5-dione, 3-chloro-4-(chloromethyl)- (CAS 339152-95-3), with molecular formula C5H3Cl2NO2 and molecular weight 178.95 g/mol. IUPAC: 3-chloro-4-(chloromethyl)pyrrole-2,5-dione.
Chemical Property Profile of 1H-Pyrrole-2,5-dione, 3-chloro-4-(chloromethyl)-
Property Insights of 1H-Pyrrole-2,5-dione, 3-chloro-4-(chloromethyl)-
The XLogP value of 0.3745 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Pyrrole-2,5-dione, 3-chloro-4-(chloromethyl)-. With a topological polar surface area (TPSA) of 46.17 Ų, 1H-Pyrrole-2,5-dione, 3-chloro-4-(chloromethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Pyrrole-2,5-dione, 3-chloro-4-(chloromethyl)- has 1 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 1H-Pyrrole-2,5-dione, 3-chloro-4-(chloromethyl)-?
The CAS number of 1H-Pyrrole-2,5-dione, 3-chloro-4-(chloromethyl)- is 339152-95-3.
What is the molecular formula of 1H-Pyrrole-2,5-dione, 3-chloro-4-(chloromethyl)-?
The molecular formula of 1H-Pyrrole-2,5-dione, 3-chloro-4-(chloromethyl)- is C5H3Cl2NO2.
What is the molecular weight of 1H-Pyrrole-2,5-dione, 3-chloro-4-(chloromethyl)-?
The molecular weight of 1H-Pyrrole-2,5-dione, 3-chloro-4-(chloromethyl)- is 178.95 g/mol.
Where can I buy 1H-Pyrrole-2,5-dione, 3-chloro-4-(chloromethyl)-?
You can request a quote for 1H-Pyrrole-2,5-dione, 3-chloro-4-(chloromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrrole-2,5-dione, 3-chloro-4-(chloromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrrole-2,5-dione, 3-chloro-4-(chloromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.