2-Chloroacrylamide
TL;DR: 2-Chloroacrylamide (CAS 16490-68-9) is a chemical compound with molecular formula C3H4ClNO and molecular weight 105.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloroprop-2-enamide
Also Known As: 2-Chloroacrylamide, 2-chloroprop-2-enamide, chloroacrylamide, 2-Chloro-2-propenamide, 2-Propenamide,2-chloro-
| Molecular Formula | C3H4ClNO |
|---|---|
| Molecular Weight | 105.00 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 104.99814 |
| Heavy Atoms | 6 |
| Complexity | 88.0 |
Chemical Identifiers
| CAS Number | 16490-68-9 |
|---|---|
| SMILES | C=C(C(=O)N)Cl |
| InChIKey | YBXYCBGDIALKAK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Chloroacrylamide (CAS 16490-68-9), with molecular formula C3H4ClNO and molecular weight 105.00 g/mol. IUPAC: 2-chloroprop-2-enamide.
Chemical Property Profile of 2-Chloroacrylamide
Property Insights of 2-Chloroacrylamide
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloroacrylamide. With a topological polar surface area (TPSA) of 43.1 Ų, 2-Chloroacrylamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloroacrylamide has 1 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-Chloroacrylamide?
The CAS number of 2-Chloroacrylamide is 16490-68-9.
What is the molecular formula of 2-Chloroacrylamide?
The molecular formula of 2-Chloroacrylamide is C3H4ClNO.
What is the molecular weight of 2-Chloroacrylamide?
The molecular weight of 2-Chloroacrylamide is 105.00 g/mol.
Where can I buy 2-Chloroacrylamide?
You can request a quote for 2-Chloroacrylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloroacrylamide?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloroacrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.