2-氯-N,N-二甲基丁酰胺
TL;DR: 2-氯-N,N-二甲基丁酰胺 (CAS 59843-83-3) is a chemical compound with molecular formula C6H12ClNO and molecular weight 149.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氯-N,N-二甲基丁酰胺
2-chloro-N,N-dimethylbutanamide
Also Known As: 2-chloro-N,N-dimethylbutanamide, Butanamide, 2-chloro-N,N-dimethyl-, 2-Chloro-N,N-dimethylbutyramide, chlorobutanoic acid dimethylamide, (S)-2-chloro-butyric acid dimethylamide
| Molecular Formula | C6H12ClNO |
|---|---|
| Molecular Weight | 149.06 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 149.06075 |
| Heavy Atoms | 9 |
| Complexity | 103.0 |
Chemical Identifiers
| CAS Number | 59843-83-3 |
|---|---|
| SMILES | CCC(C(=O)N(C)C)Cl |
| InChIKey | UCELCVSCXNSTPP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-氯-N,N-二甲基丁酰胺 (CAS 59843-83-3), with molecular formula C6H12ClNO and molecular weight 149.06 g/mol. IUPAC: 2-chloro-N,N-dimethylbutanamide.
Chemical Property Profile of 2-氯-N,N-二甲基丁酰胺
Property Insights of 2-氯-N,N-二甲基丁酰胺
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-氯-N,N-二甲基丁酰胺. With a topological polar surface area (TPSA) of 20.3 Ų, 2-氯-N,N-二甲基丁酰胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-氯-N,N-二甲基丁酰胺 has 0 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-氯-N,N-二甲基丁酰胺?
The CAS number of 2-氯-N,N-二甲基丁酰胺 is 59843-83-3.
What is the molecular formula of 2-氯-N,N-二甲基丁酰胺?
The molecular formula of 2-氯-N,N-二甲基丁酰胺 is C6H12ClNO.
What is the molecular weight of 2-氯-N,N-二甲基丁酰胺?
The molecular weight of 2-氯-N,N-二甲基丁酰胺 is 149.06 g/mol.
Where can I buy 2-氯-N,N-二甲基丁酰胺?
You can request a quote for 2-氯-N,N-二甲基丁酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-氯-N,N-二甲基丁酰胺?
Yes, KEHONG BIO provides custom synthesis services for 2-氯-N,N-二甲基丁酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.