2-(Methylcarbamoyloxy)propyl 2-chloroacetate
TL;DR: 2-(Methylcarbamoyloxy)propyl 2-chloroacetate (CAS 1154-38-7) is a chemical compound with molecular formula C7H12ClNO4 and molecular weight 209.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(methylcarbamoyloxy)propyl 2-chloroacetate
Also Known As: 2-(methylcarbamoyloxy)propyl 2-chloroacetate, 2-[(methylcarbamoyl)oxy]propyl chloroacetate, (S)-N,N'-dimethyl-3-phenyl-propane-1,2-diamine, 2-[Hydroxy(methylimino)methoxy]propyl chloroacetate, Acetic acid, chloro-, 2-(((methylamino)carbonyl)oxy)propyl ester
| Molecular Formula | C7H12ClNO4 |
|---|---|
| Molecular Weight | 209.05 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 209.04549 |
| Heavy Atoms | 13 |
| Complexity | 185.0 |
Chemical Identifiers
| CAS Number | 1154-38-7 |
|---|---|
| SMILES | CC(COC(=O)CCl)OC(=O)NC |
| InChIKey | IVQURJBNSNOPHE-UHFFFAOYSA-N |
Product Overview
2-(Methylcarbamoyloxy)propyl 2-chloroacetate (CAS 1154-38-7), with molecular formula C7H12ClNO4 and molecular weight 209.05 g/mol. IUPAC: 2-(methylcarbamoyloxy)propyl 2-chloroacetate.
Chemical Property Profile of 2-(Methylcarbamoyloxy)propyl 2-chloroacetate
Property Insights of 2-(Methylcarbamoyloxy)propyl 2-chloroacetate
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Methylcarbamoyloxy)propyl 2-chloroacetate. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Methylcarbamoyloxy)propyl 2-chloroacetate. Following Lipinski's Rule of Five, 2-(Methylcarbamoyloxy)propyl 2-chloroacetate has 1 hydrogen bond donor(s) and 4 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-(Methylcarbamoyloxy)propyl 2-chloroacetate?
The CAS number of 2-(Methylcarbamoyloxy)propyl 2-chloroacetate is 1154-38-7.
What is the molecular formula of 2-(Methylcarbamoyloxy)propyl 2-chloroacetate?
The molecular formula of 2-(Methylcarbamoyloxy)propyl 2-chloroacetate is C7H12ClNO4.
What is the molecular weight of 2-(Methylcarbamoyloxy)propyl 2-chloroacetate?
The molecular weight of 2-(Methylcarbamoyloxy)propyl 2-chloroacetate is 209.05 g/mol.
Where can I buy 2-(Methylcarbamoyloxy)propyl 2-chloroacetate?
You can request a quote for 2-(Methylcarbamoyloxy)propyl 2-chloroacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Methylcarbamoyloxy)propyl 2-chloroacetate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Methylcarbamoyloxy)propyl 2-chloroacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.