3-(1-Chloroethyl)-4-methyl-2,5-pyrrolidinedione
TL;DR: 3-(1-Chloroethyl)-4-methyl-2,5-pyrrolidinedione (CAS 54124-15-1) is a chemical compound with molecular formula C7H10ClNO2 and molecular weight 175.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-chloroethyl)-4-methylpyrrolidine-2,5-dione
Also Known As: 3- -4-methyl-2,5-pyrrolidinedione, 3-(1-Chloroethyl)-4-methyl-2,5-pyrrolidinedione, 3-(1-chloroethyl)-4-methylpyrrolidine-2,5-dione, 2,5-Pyrrolidinedione, 3-(1-chloroethyl)-4-methyl-, 3-(1-Chloroethyl)-4-methyl-2,5-pyrrolidinedione #
| Molecular Formula | C7H10ClNO2 |
|---|---|
| Molecular Weight | 175.04 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 175.04001 |
| Heavy Atoms | 11 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 54124-15-1 |
|---|---|
| SMILES | CC1C(C(=O)NC1=O)C(C)Cl |
| InChIKey | WDOOKIZFYIATPF-UHFFFAOYSA-N |
Product Overview
3-(1-Chloroethyl)-4-methyl-2,5-pyrrolidinedione (CAS 54124-15-1), with molecular formula C7H10ClNO2 and molecular weight 175.04 g/mol. IUPAC: 3-(1-chloroethyl)-4-methylpyrrolidine-2,5-dione.
Chemical Property Profile of 3-(1-Chloroethyl)-4-methyl-2,5-pyrrolidinedione
Property Insights of 3-(1-Chloroethyl)-4-methyl-2,5-pyrrolidinedione
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1-Chloroethyl)-4-methyl-2,5-pyrrolidinedione. With a topological polar surface area (TPSA) of 46.2 Ų, 3-(1-Chloroethyl)-4-methyl-2,5-pyrrolidinedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1-Chloroethyl)-4-methyl-2,5-pyrrolidinedione 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 3-(1-Chloroethyl)-4-methyl-2,5-pyrrolidinedione?
The CAS number of 3-(1-Chloroethyl)-4-methyl-2,5-pyrrolidinedione is 54124-15-1.
What is the molecular formula of 3-(1-Chloroethyl)-4-methyl-2,5-pyrrolidinedione?
The molecular formula of 3-(1-Chloroethyl)-4-methyl-2,5-pyrrolidinedione is C7H10ClNO2.
What is the molecular weight of 3-(1-Chloroethyl)-4-methyl-2,5-pyrrolidinedione?
The molecular weight of 3-(1-Chloroethyl)-4-methyl-2,5-pyrrolidinedione is 175.04 g/mol.
Where can I buy 3-(1-Chloroethyl)-4-methyl-2,5-pyrrolidinedione?
You can request a quote for 3-(1-Chloroethyl)-4-methyl-2,5-pyrrolidinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1-Chloroethyl)-4-methyl-2,5-pyrrolidinedione?
Yes, KEHONG BIO provides custom synthesis services for 3-(1-Chloroethyl)-4-methyl-2,5-pyrrolidinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.