Hydroxycarbamic acid hexyl ester
TL;DR: Hydroxycarbamic acid hexyl ester (CAS 592-70-1) is a chemical compound with molecular formula C7H15NO3 and molecular weight 161.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hexyl N-hydroxycarbamate
Also Known As: Hexyl hydroxycarbamate, hexyl N-hydroxycarbamate, n-Hexyl N-hydroxycarbamate, Hydroxycarbamic acid hexyl ester, Hexyl hydrogen hydroxycarbonimidate
| Molecular Formula | C7H15NO3 |
|---|---|
| Molecular Weight | 161.11 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 161.1052 |
| Heavy Atoms | 11 |
| Complexity | 106.0 |
Chemical Identifiers
| CAS Number | 592-70-1 |
|---|---|
| SMILES | CCCCCCOC(=O)NO |
| InChIKey | XDRRRJZZMBWXHF-UHFFFAOYSA-N |
Product Overview
Hydroxycarbamic acid hexyl ester (CAS 592-70-1), with molecular formula C7H15NO3 and molecular weight 161.11 g/mol. IUPAC: hexyl N-hydroxycarbamate.
Chemical Property Profile of Hydroxycarbamic acid hexyl ester
Property Insights of Hydroxycarbamic acid hexyl ester
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydroxycarbamic acid hexyl ester. With a topological polar surface area (TPSA) of 58.6 Ų, Hydroxycarbamic acid hexyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hydroxycarbamic acid hexyl ester has 2 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 Hydroxycarbamic acid hexyl ester?
The CAS number of Hydroxycarbamic acid hexyl ester is 592-70-1.
What is the molecular formula of Hydroxycarbamic acid hexyl ester?
The molecular formula of Hydroxycarbamic acid hexyl ester is C7H15NO3.
What is the molecular weight of Hydroxycarbamic acid hexyl ester?
The molecular weight of Hydroxycarbamic acid hexyl ester is 161.11 g/mol.
Where can I buy Hydroxycarbamic acid hexyl ester?
You can request a quote for Hydroxycarbamic acid hexyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydroxycarbamic acid hexyl ester?
Yes, KEHONG BIO provides custom synthesis services for Hydroxycarbamic acid hexyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.