Propanimidoyl chloride, N-((chloroacetyl)oxy)-2-methyl-
TL;DR: Propanimidoyl chloride, N-((chloroacetyl)oxy)-2-methyl- (CAS 126794-91-0) is a chemical compound with molecular formula C6H9Cl2NO2 and molecular weight 197.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(Z)-(1-chloro-2-methylpropylidene)amino] 2-chloroacetate
Also Known As: N-((Chloroacetyl)oxy)-2-methylpropanimidoyl chloride, Propanimidoyl chloride, N-((chloroacetyl)oxy)-2-methyl-, RefChem:1096822, BRN 4244931
| Molecular Formula | C6H9Cl2NO2 |
|---|---|
| Molecular Weight | 197.00 g/mol |
| LogP | 1.9767 |
| Topological Polar Surface Area | 38.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 197.00104 |
| Heavy Atoms | 11 |
| Complexity | 167.96523 |
Chemical Identifiers
| CAS Number | 126794-91-0 |
|---|---|
| SMILES | CC(C)/C(=N/OC(=O)CCl)/Cl |
Product Overview
Propanimidoyl chloride, N-((chloroacetyl)oxy)-2-methyl- (CAS 126794-91-0), with molecular formula C6H9Cl2NO2 and molecular weight 197.00 g/mol. IUPAC: [(Z)-(1-chloro-2-methylpropylidene)amino] 2-chloroacetate.
Chemical Property Profile of Propanimidoyl chloride, N-((chloroacetyl)oxy)-2-methyl-
Property Insights of Propanimidoyl chloride, N-((chloroacetyl)oxy)-2-methyl-
The XLogP value of 1.9767 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propanimidoyl chloride, N-((chloroacetyl)oxy)-2-methyl-. With a topological polar surface area (TPSA) of 38.66 Ų, Propanimidoyl chloride, N-((chloroacetyl)oxy)-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propanimidoyl chloride, N-((chloroacetyl)oxy)-2-methyl- has 0 hydrogen bond donor(s) and 3 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 Propanimidoyl chloride, N-((chloroacetyl)oxy)-2-methyl-?
The CAS number of Propanimidoyl chloride, N-((chloroacetyl)oxy)-2-methyl- is 126794-91-0.
What is the molecular formula of Propanimidoyl chloride, N-((chloroacetyl)oxy)-2-methyl-?
The molecular formula of Propanimidoyl chloride, N-((chloroacetyl)oxy)-2-methyl- is C6H9Cl2NO2.
What is the molecular weight of Propanimidoyl chloride, N-((chloroacetyl)oxy)-2-methyl-?
The molecular weight of Propanimidoyl chloride, N-((chloroacetyl)oxy)-2-methyl- is 197.00 g/mol.
Where can I buy Propanimidoyl chloride, N-((chloroacetyl)oxy)-2-methyl-?
You can request a quote for Propanimidoyl chloride, N-((chloroacetyl)oxy)-2-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanimidoyl chloride, N-((chloroacetyl)oxy)-2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Propanimidoyl chloride, N-((chloroacetyl)oxy)-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.