1-(Chloroamino)acetone
TL;DR: 1-(Chloroamino)acetone (CAS 71501-36-5) is a chemical compound with molecular formula C3H6ClNO and molecular weight 107.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(chloroamino)propan-2-one
Also Known As: 1-(Chloroamino)acetone, 1- acetone, 1-(chloroamino)propan-2-one, 1-Chloroamino-2-propanone, EINECS 275-564-6
| Molecular Formula | C3H6ClNO |
|---|---|
| Molecular Weight | 107.01 g/mol |
| LogP | 0.3188 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 107.013794 |
| Heavy Atoms | 6 |
| Complexity | 54.754887 |
Chemical Identifiers
| CAS Number | 71501-36-5 |
|---|---|
| SMILES | CC(=O)CNCl |
Product Overview
1-(Chloroamino)acetone (CAS 71501-36-5), with molecular formula C3H6ClNO and molecular weight 107.01 g/mol. IUPAC: 1-(chloroamino)propan-2-one.
Chemical Property Profile of 1-(Chloroamino)acetone
Property Insights of 1-(Chloroamino)acetone
The XLogP value of 0.3188 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Chloroamino)acetone. With a topological polar surface area (TPSA) of 29.1 Ų, 1-(Chloroamino)acetone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Chloroamino)acetone 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 1-(Chloroamino)acetone?
The CAS number of 1-(Chloroamino)acetone is 71501-36-5.
What is the molecular formula of 1-(Chloroamino)acetone?
The molecular formula of 1-(Chloroamino)acetone is C3H6ClNO.
What is the molecular weight of 1-(Chloroamino)acetone?
The molecular weight of 1-(Chloroamino)acetone is 107.01 g/mol.
Where can I buy 1-(Chloroamino)acetone?
You can request a quote for 1-(Chloroamino)acetone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Chloroamino)acetone?
Yes, KEHONG BIO provides custom synthesis services for 1-(Chloroamino)acetone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.