1-Acetamido-3-chloropropan-2-yl acetate
TL;DR: 1-Acetamido-3-chloropropan-2-yl acetate (CAS 183905-31-9) is a chemical compound with molecular formula C7H12ClNO3 and molecular weight 193.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-acetamido-3-chloropropan-2-yl) acetate
Also Known As: 1-Acetamido-3-chloropropan-2-yl acetate, (S)-1-Acetamido-3-chloropropan-2-yl acetate, (1-acetamido-3-chloropropan-2-yl) acetate, 1-Acetamido-3-chloropropan-2-ylacetate, [(2S)-1-acetamido-3-chloropropan-2-yl] acetate
| Molecular Formula | C7H12ClNO3 |
|---|---|
| Molecular Weight | 193.05 g/mol |
| LogP | 0.293 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 193.05057 |
| Heavy Atoms | 12 |
| Complexity | 172.03442 |
Chemical Identifiers
| CAS Number | 183905-31-9 |
|---|---|
| SMILES | CC(=O)NCC(CCl)OC(=O)C |
Product Overview
1-Acetamido-3-chloropropan-2-yl acetate (CAS 183905-31-9), with molecular formula C7H12ClNO3 and molecular weight 193.05 g/mol. IUPAC: (1-acetamido-3-chloropropan-2-yl) acetate.
Chemical Property Profile of 1-Acetamido-3-chloropropan-2-yl acetate
Property Insights of 1-Acetamido-3-chloropropan-2-yl acetate
The XLogP value of 0.293 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Acetamido-3-chloropropan-2-yl acetate. With a topological polar surface area (TPSA) of 55.4 Ų, 1-Acetamido-3-chloropropan-2-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Acetamido-3-chloropropan-2-yl acetate has 1 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 1-Acetamido-3-chloropropan-2-yl acetate?
The CAS number of 1-Acetamido-3-chloropropan-2-yl acetate is 183905-31-9.
What is the molecular formula of 1-Acetamido-3-chloropropan-2-yl acetate?
The molecular formula of 1-Acetamido-3-chloropropan-2-yl acetate is C7H12ClNO3.
What is the molecular weight of 1-Acetamido-3-chloropropan-2-yl acetate?
The molecular weight of 1-Acetamido-3-chloropropan-2-yl acetate is 193.05 g/mol.
Where can I buy 1-Acetamido-3-chloropropan-2-yl acetate?
You can request a quote for 1-Acetamido-3-chloropropan-2-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Acetamido-3-chloropropan-2-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 1-Acetamido-3-chloropropan-2-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.