Acetoacetyl-2-chloroanilide
TL;DR: Acetoacetyl-2-chloroanilide (CAS 93-70-9) is a chemical compound with molecular formula C10H10ClNO2 and molecular weight 211.04001 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-chlorophenyl)-3-oxobutanamide
Also Known As: 2'-Chloroacetoacetanilide, AAoC, N-(2-Chlorophenyl)-3-oxobutanamide, o-Chloroacetoacetanilide, Acetoacet-o-chloroanilide
Application Areas
Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H10ClNO2 |
| Molecular Weight | 211.04001 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 211.04001 Da |
| Heavy Atoms | 14 |
| Complexity | 230.0 |
| SMILES | CC(=O)CC(=O)NC1=CC=CC=C1Cl |
| InChIKey | BFVHBHKMLIBQNN-UHFFFAOYSA-N |
Product Description
Applications: Acetoacetyl-2-chloroanilide is used in dye and pigment synthesis and coloration chemistry, as well as textile processing, dyeing, and finishing operations. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Acetoacetyl-2-chloroanilide is a dye and pigment intermediate identified by CAS number 93-70-9 and the molecular formula C10H10ClNO2 and a molecular weight of 211.04 g/mol. Synonyms include 2'-Chloroacetoacetanilide and AAoC.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Acetoacetyl-2-chloroanilide
Property Insights of Acetoacetyl-2-chloroanilide
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetoacetyl-2-chloroanilide. With a topological polar surface area (TPSA) of 46.2 Ų, Acetoacetyl-2-chloroanilide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetoacetyl-2-chloroanilide 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
What is the CAS number of Acetoacetyl-2-chloroanilide?
The CAS number of Acetoacetyl-2-chloroanilide is 93-70-9.
What is the molecular formula of Acetoacetyl-2-chloroanilide?
The molecular formula of Acetoacetyl-2-chloroanilide is C10H10ClNO2.
What is the molecular weight of Acetoacetyl-2-chloroanilide?
The molecular weight of Acetoacetyl-2-chloroanilide is 211.04001 g/mol.
What are the applications of Acetoacetyl-2-chloroanilide?
Acetoacetyl-2-chloroanilide is used in dye and pigment synthesis and coloration chemistry, as well as textile processing, dyeing, and finishing operations. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis...
Where can I buy Acetoacetyl-2-chloroanilide?
You can request a quote for Acetoacetyl-2-chloroanilide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acetoacetyl-2-chloroanilide?
Yes, CoreyChem provides custom synthesis services for Acetoacetyl-2-chloroanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.