ethyl N-[[4-(hydroxymethyl)cyclohexyl]methyl]carbamate
TL;DR: ethyl N-[[4-(hydroxymethyl)cyclohexyl]methyl]carbamate (CAS 91241-65-5) is a chemical compound with molecular formula C11H21NO3 and molecular weight 215.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[[4-(hydroxymethyl)cyclohexyl]methyl]carbamate
Also Known As: Hexahydro-quinolizine-4,6-dione, ethyl N-[[4-(hydroxymethyl)cyclohexyl]methyl]carbamate, Ethyl {[4-(hydroxymethyl)cyclohexyl]methyl}carbamate
| Molecular Formula | C11H21NO3 |
|---|---|
| Molecular Weight | 215.15 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 215.15215 |
| Heavy Atoms | 15 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 91241-65-5 |
|---|---|
| SMILES | CCOC(=O)NCC1CCC(CC1)CO |
| InChIKey | FLKIQKGKZXWQRJ-UHFFFAOYSA-N |
Product Overview
ethyl N-[[4-(hydroxymethyl)cyclohexyl]methyl]carbamate (CAS 91241-65-5), with molecular formula C11H21NO3 and molecular weight 215.15 g/mol. IUPAC: ethyl N-[[4-(hydroxymethyl)cyclohexyl]methyl]carbamate.
Chemical Property Profile of ethyl N-[[4-(hydroxymethyl)cyclohexyl]methyl]carbamate
Property Insights of ethyl N-[[4-(hydroxymethyl)cyclohexyl]methyl]carbamate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl N-[[4-(hydroxymethyl)cyclohexyl]methyl]carbamate. With a topological polar surface area (TPSA) of 58.6 Ų, ethyl N-[[4-(hydroxymethyl)cyclohexyl]methyl]carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl N-[[4-(hydroxymethyl)cyclohexyl]methyl]carbamate 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 ethyl N-[[4-(hydroxymethyl)cyclohexyl]methyl]carbamate?
The CAS number of ethyl N-[[4-(hydroxymethyl)cyclohexyl]methyl]carbamate is 91241-65-5.
What is the molecular formula of ethyl N-[[4-(hydroxymethyl)cyclohexyl]methyl]carbamate?
The molecular formula of ethyl N-[[4-(hydroxymethyl)cyclohexyl]methyl]carbamate is C11H21NO3.
What is the molecular weight of ethyl N-[[4-(hydroxymethyl)cyclohexyl]methyl]carbamate?
The molecular weight of ethyl N-[[4-(hydroxymethyl)cyclohexyl]methyl]carbamate is 215.15 g/mol.
Where can I buy ethyl N-[[4-(hydroxymethyl)cyclohexyl]methyl]carbamate?
You can request a quote for ethyl N-[[4-(hydroxymethyl)cyclohexyl]methyl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl N-[[4-(hydroxymethyl)cyclohexyl]methyl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for ethyl N-[[4-(hydroxymethyl)cyclohexyl]methyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.