Acetamide, N-(1-methylhexyl)-
TL;DR: Acetamide, N-(1-methylhexyl)- (CAS 77912-87-9) is a chemical compound with molecular formula C9H19NO and molecular weight 157.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-heptan-2-ylacetamide
Also Known As: 2-Acetylaminoheptane, N-(2-Heptanyl)acetamide, n-(heptan-2-yl)acetamide, N-heptan-2-ylacetamide, Acetamide, N-(1-methylhexyl)-
| Molecular Formula | C9H19NO |
|---|---|
| Molecular Weight | 157.15 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 157.14667 |
| Heavy Atoms | 11 |
| Complexity | 112.0 |
Chemical Identifiers
| CAS Number | 77912-87-9 |
|---|---|
| SMILES | CCCCCC(C)NC(=O)C |
| InChIKey | XNHVITOEQJZLQB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Acetamide, N-(1-methylhexyl)- (CAS 77912-87-9), with molecular formula C9H19NO and molecular weight 157.15 g/mol. IUPAC: N-heptan-2-ylacetamide.
Chemical Property Profile of Acetamide, N-(1-methylhexyl)-
Property Insights of Acetamide, N-(1-methylhexyl)-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetamide, N-(1-methylhexyl)-. With a topological polar surface area (TPSA) of 29.1 Ų, Acetamide, N-(1-methylhexyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetamide, N-(1-methylhexyl)- 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 Acetamide, N-(1-methylhexyl)-?
The CAS number of Acetamide, N-(1-methylhexyl)- is 77912-87-9.
What is the molecular formula of Acetamide, N-(1-methylhexyl)-?
The molecular formula of Acetamide, N-(1-methylhexyl)- is C9H19NO.
What is the molecular weight of Acetamide, N-(1-methylhexyl)-?
The molecular weight of Acetamide, N-(1-methylhexyl)- is 157.15 g/mol.
Where can I buy Acetamide, N-(1-methylhexyl)-?
You can request a quote for Acetamide, N-(1-methylhexyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetamide, N-(1-methylhexyl)-?
Yes, KEHONG BIO provides custom synthesis services for Acetamide, N-(1-methylhexyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.