1-Cyano-1-methylethyl cyclohexylcarbamate
TL;DR: 1-Cyano-1-methylethyl cyclohexylcarbamate (CAS 339350-90-2) is a chemical compound with molecular formula C11H18N2O2 and molecular weight 210.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyanopropan-2-yl N-cyclohexylcarbamate
Also Known As: 2-cyanopropan-2-yl N-cyclohexylcarbamate, 1-cyano-1-methylethyl cyclohexylcarbamate, 1-cyano-1-methylethyl N-cyclohexylcarbamate, Carbamicacid,cyclohexyl-,1-cyano-1-methylethylester, Carbamic acid, cyclohexyl-, 1-cyano-1-methylethyl ester (9CI)
| Molecular Formula | C11H18N2O2 |
|---|---|
| Molecular Weight | 210.14 g/mol |
| LogP | 2.34748 |
| Topological Polar Surface Area | 62.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 210.13683 |
| Heavy Atoms | 15 |
| Complexity | 262.2517 |
Chemical Identifiers
| CAS Number | 339350-90-2 |
|---|---|
| SMILES | CC(C)(C#N)OC(=O)NC1CCCCC1 |
Product Overview
1-Cyano-1-methylethyl cyclohexylcarbamate (CAS 339350-90-2), with molecular formula C11H18N2O2 and molecular weight 210.14 g/mol. IUPAC: 2-cyanopropan-2-yl N-cyclohexylcarbamate.
Chemical Property Profile of 1-Cyano-1-methylethyl cyclohexylcarbamate
Property Insights of 1-Cyano-1-methylethyl cyclohexylcarbamate
The XLogP value of 2.34748 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Cyano-1-methylethyl cyclohexylcarbamate. The TPSA of 62.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Cyano-1-methylethyl cyclohexylcarbamate. Following Lipinski's Rule of Five, 1-Cyano-1-methylethyl cyclohexylcarbamate 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 1-Cyano-1-methylethyl cyclohexylcarbamate?
The CAS number of 1-Cyano-1-methylethyl cyclohexylcarbamate is 339350-90-2.
What is the molecular formula of 1-Cyano-1-methylethyl cyclohexylcarbamate?
The molecular formula of 1-Cyano-1-methylethyl cyclohexylcarbamate is C11H18N2O2.
What is the molecular weight of 1-Cyano-1-methylethyl cyclohexylcarbamate?
The molecular weight of 1-Cyano-1-methylethyl cyclohexylcarbamate is 210.14 g/mol.
Where can I buy 1-Cyano-1-methylethyl cyclohexylcarbamate?
You can request a quote for 1-Cyano-1-methylethyl cyclohexylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Cyano-1-methylethyl cyclohexylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 1-Cyano-1-methylethyl cyclohexylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.