2-Pyrrolidinone, 3,3-dichloro-4-(chloromethyl)-1-(2-propenyl)-
TL;DR: 2-Pyrrolidinone, 3,3-dichloro-4-(chloromethyl)-1-(2-propenyl)- (CAS 61213-07-8) is a chemical compound with molecular formula C8H10Cl3NO and molecular weight 240.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dichloro-4-(chloromethyl)-1-prop-2-enylpyrrolidin-2-one
Also Known As: 2-Pyrrolidinone, 3,3-dichloro-4-(chloromethyl)-1-(2-propenyl)-, 3,3-Dichloro-4-chloromethyl-1-allyl-2-pyrrolidone, 1-allyl-3,3-dichloro-4-chloromethyl-pyrrolidin-2-one, 3,3-dichloro-4-(chloromethyl)-1-prop-2-enylpyrrolidin-2-one, 1-Allyl-3,3-dichloro-4-(chloromethyl)pyrrolidine 2-one
| Molecular Formula | C8H10Cl3NO |
|---|---|
| Molecular Weight | 240.98 g/mol |
| LogP | 2.0435 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 240.9828 |
| Heavy Atoms | 13 |
| Complexity | 229.42903 |
Chemical Identifiers
| CAS Number | 61213-07-8 |
|---|---|
| SMILES | C=CCN1CC(C(C1=O)(Cl)Cl)CCl |
Product Overview
2-Pyrrolidinone, 3,3-dichloro-4-(chloromethyl)-1-(2-propenyl)- (CAS 61213-07-8), with molecular formula C8H10Cl3NO and molecular weight 240.98 g/mol. IUPAC: 3,3-dichloro-4-(chloromethyl)-1-prop-2-enylpyrrolidin-2-one.
Chemical Property Profile of 2-Pyrrolidinone, 3,3-dichloro-4-(chloromethyl)-1-(2-propenyl)-
Property Insights of 2-Pyrrolidinone, 3,3-dichloro-4-(chloromethyl)-1-(2-propenyl)-
The XLogP value of 2.0435 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pyrrolidinone, 3,3-dichloro-4-(chloromethyl)-1-(2-propenyl)-. With a topological polar surface area (TPSA) of 20.31 Ų, 2-Pyrrolidinone, 3,3-dichloro-4-(chloromethyl)-1-(2-propenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyrrolidinone, 3,3-dichloro-4-(chloromethyl)-1-(2-propenyl)- has 0 hydrogen bond donor(s) and 1 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-Pyrrolidinone, 3,3-dichloro-4-(chloromethyl)-1-(2-propenyl)-?
The CAS number of 2-Pyrrolidinone, 3,3-dichloro-4-(chloromethyl)-1-(2-propenyl)- is 61213-07-8.
What is the molecular formula of 2-Pyrrolidinone, 3,3-dichloro-4-(chloromethyl)-1-(2-propenyl)-?
The molecular formula of 2-Pyrrolidinone, 3,3-dichloro-4-(chloromethyl)-1-(2-propenyl)- is C8H10Cl3NO.
What is the molecular weight of 2-Pyrrolidinone, 3,3-dichloro-4-(chloromethyl)-1-(2-propenyl)-?
The molecular weight of 2-Pyrrolidinone, 3,3-dichloro-4-(chloromethyl)-1-(2-propenyl)- is 240.98 g/mol.
Where can I buy 2-Pyrrolidinone, 3,3-dichloro-4-(chloromethyl)-1-(2-propenyl)-?
You can request a quote for 2-Pyrrolidinone, 3,3-dichloro-4-(chloromethyl)-1-(2-propenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pyrrolidinone, 3,3-dichloro-4-(chloromethyl)-1-(2-propenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Pyrrolidinone, 3,3-dichloro-4-(chloromethyl)-1-(2-propenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.