n-Hexan-2-ylformamide
TL;DR: n-Hexan-2-ylformamide (CAS 53664-33-8) is a chemical compound with molecular formula C7H15NO and molecular weight 129.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-hexan-2-ylformamide
Also Known As: n-hexan-2-ylformamide, Formamide, N-2-hexyl-, Formamide, N-(1-methylpentyl)-, N-(HEXAN-2-YL)FORMAMIDE
| Molecular Formula | C7H15NO |
|---|---|
| Molecular Weight | 129.12 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 129.11537 |
| Heavy Atoms | 9 |
| Complexity | 73.0 |
Chemical Identifiers
| CAS Number | 53664-33-8 |
|---|---|
| SMILES | CCCCC(C)NC=O |
| InChIKey | WTRQWLYNDCUXGO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
n-Hexan-2-ylformamide (CAS 53664-33-8), with molecular formula C7H15NO and molecular weight 129.12 g/mol. IUPAC: N-hexan-2-ylformamide.
Chemical Property Profile of n-Hexan-2-ylformamide
Property Insights of n-Hexan-2-ylformamide
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n-Hexan-2-ylformamide. With a topological polar surface area (TPSA) of 29.1 Ų, n-Hexan-2-ylformamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n-Hexan-2-ylformamide 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 n-Hexan-2-ylformamide?
The CAS number of n-Hexan-2-ylformamide is 53664-33-8.
What is the molecular formula of n-Hexan-2-ylformamide?
The molecular formula of n-Hexan-2-ylformamide is C7H15NO.
What is the molecular weight of n-Hexan-2-ylformamide?
The molecular weight of n-Hexan-2-ylformamide is 129.12 g/mol.
Where can I buy n-Hexan-2-ylformamide?
You can request a quote for n-Hexan-2-ylformamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-Hexan-2-ylformamide?
Yes, KEHONG BIO provides custom synthesis services for n-Hexan-2-ylformamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.