3-Chloro-2,2-dimethylpropanamide
TL;DR: 3-Chloro-2,2-dimethylpropanamide (CAS 41461-75-0) is a chemical compound with molecular formula C5H10ClNO and molecular weight 135.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-2,2-dimethylpropanamide
Also Known As: 3-Chloro-2,2-dimethylpropanamide, chloro-pivalic acid amide, Propanamide, 3-chloro-2,2-dimethyl-, 2,2-Dimethyl-3-chloropropanamide, 3-chloro-2,2-dimethyl-propanamide
| Molecular Formula | C5H10ClNO |
|---|---|
| Molecular Weight | 135.05 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 135.04509 |
| Heavy Atoms | 8 |
| Complexity | 101.0 |
Chemical Identifiers
| CAS Number | 41461-75-0 |
|---|---|
| SMILES | CC(C)(CCl)C(=O)N |
| InChIKey | CCFNEVMWSYAQKL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Chloro-2,2-dimethylpropanamide (CAS 41461-75-0), with molecular formula C5H10ClNO and molecular weight 135.05 g/mol. IUPAC: 3-chloro-2,2-dimethylpropanamide.
Chemical Property Profile of 3-Chloro-2,2-dimethylpropanamide
Property Insights of 3-Chloro-2,2-dimethylpropanamide
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chloro-2,2-dimethylpropanamide. With a topological polar surface area (TPSA) of 43.1 Ų, 3-Chloro-2,2-dimethylpropanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-2,2-dimethylpropanamide 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 3-Chloro-2,2-dimethylpropanamide?
The CAS number of 3-Chloro-2,2-dimethylpropanamide is 41461-75-0.
What is the molecular formula of 3-Chloro-2,2-dimethylpropanamide?
The molecular formula of 3-Chloro-2,2-dimethylpropanamide is C5H10ClNO.
What is the molecular weight of 3-Chloro-2,2-dimethylpropanamide?
The molecular weight of 3-Chloro-2,2-dimethylpropanamide is 135.05 g/mol.
Where can I buy 3-Chloro-2,2-dimethylpropanamide?
You can request a quote for 3-Chloro-2,2-dimethylpropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-2,2-dimethylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-2,2-dimethylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.