Ethyl 6-formamidohexanoate
TL;DR: Ethyl 6-formamidohexanoate (CAS 1117-67-5) is a chemical compound with molecular formula C9H17NO3 and molecular weight 187.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-formamidohexanoate
Also Known As: Ethyl 6-formamidohexanoate, Ethyl 6-(formylamino)hexanoate, Ethyl 6-(formylamino)hexanoate #, 6-(Formylamino)hexanoic acid ethyl ester, J1.406.700K
| Molecular Formula | C9H17NO3 |
|---|---|
| Molecular Weight | 187.12 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 187.12085 |
| Heavy Atoms | 13 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 1117-67-5 |
|---|---|
| SMILES | CCOC(=O)CCCCCNC=O |
| InChIKey | LVLDVHLLPXAJBW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 6-formamidohexanoate (CAS 1117-67-5), with molecular formula C9H17NO3 and molecular weight 187.12 g/mol. IUPAC: ethyl 6-formamidohexanoate.
Chemical Property Profile of Ethyl 6-formamidohexanoate
Property Insights of Ethyl 6-formamidohexanoate
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 6-formamidohexanoate. With a topological polar surface area (TPSA) of 55.4 Ų, Ethyl 6-formamidohexanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 6-formamidohexanoate has 1 hydrogen bond donor(s) and 3 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 Ethyl 6-formamidohexanoate?
The CAS number of Ethyl 6-formamidohexanoate is 1117-67-5.
What is the molecular formula of Ethyl 6-formamidohexanoate?
The molecular formula of Ethyl 6-formamidohexanoate is C9H17NO3.
What is the molecular weight of Ethyl 6-formamidohexanoate?
The molecular weight of Ethyl 6-formamidohexanoate is 187.12 g/mol.
Where can I buy Ethyl 6-formamidohexanoate?
You can request a quote for Ethyl 6-formamidohexanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 6-formamidohexanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 6-formamidohexanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.