2-chloro-N-(heptan-2-yl)acetamide
TL;DR: 2-chloro-N-(heptan-2-yl)acetamide (CAS 196875-71-5) is a chemical compound with molecular formula C9H18ClNO and molecular weight 191.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-heptan-2-ylacetamide
Also Known As: 2-chloro-N-(heptan-2-yl)acetamide, 2-chloro-N-(1-methylhexyl)acetamide, 2-chloro-N-heptan-2-ylacetamide, N-(1-Methylhexyl)-2-chloroacetamide, UPCMLD0ENAT5483176:001
| Molecular Formula | C9H18ClNO |
|---|---|
| Molecular Weight | 191.11 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 191.1077 |
| Heavy Atoms | 12 |
| Complexity | 128.0 |
Chemical Identifiers
| CAS Number | 196875-71-5 |
|---|---|
| SMILES | CCCCCC(C)NC(=O)CCl |
| InChIKey | OVPAMQUUIXGWGZ-UHFFFAOYSA-N |
Product Overview
2-chloro-N-(heptan-2-yl)acetamide (CAS 196875-71-5), with molecular formula C9H18ClNO and molecular weight 191.11 g/mol. IUPAC: 2-chloro-N-heptan-2-ylacetamide.
Chemical Property Profile of 2-chloro-N-(heptan-2-yl)acetamide
Property Insights of 2-chloro-N-(heptan-2-yl)acetamide
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-N-(heptan-2-yl)acetamide. With a topological polar surface area (TPSA) of 29.1 Ų, 2-chloro-N-(heptan-2-yl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-N-(heptan-2-yl)acetamide 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-chloro-N-(heptan-2-yl)acetamide?
The CAS number of 2-chloro-N-(heptan-2-yl)acetamide is 196875-71-5.
What is the molecular formula of 2-chloro-N-(heptan-2-yl)acetamide?
The molecular formula of 2-chloro-N-(heptan-2-yl)acetamide is C9H18ClNO.
What is the molecular weight of 2-chloro-N-(heptan-2-yl)acetamide?
The molecular weight of 2-chloro-N-(heptan-2-yl)acetamide is 191.11 g/mol.
Where can I buy 2-chloro-N-(heptan-2-yl)acetamide?
You can request a quote for 2-chloro-N-(heptan-2-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-(heptan-2-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-(heptan-2-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.