methyl N-octylcarbamate
TL;DR: methyl N-octylcarbamate (CAS 36598-10-4) is a chemical compound with molecular formula C10H21NO2 and molecular weight 187.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-octylcarbamate
Also Known As: Methyl N-octylcarbamate, Octylcarbamic acid methyl ester, Carbamic acid, N-octyl-, methyl ester, US8815951, 72
| Molecular Formula | C10H21NO2 |
|---|---|
| Molecular Weight | 187.16 g/mol |
| LogP | 2.7029 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 187.15723 |
| Heavy Atoms | 13 |
| Complexity | 126.093155 |
Chemical Identifiers
| CAS Number | 36598-10-4 |
|---|---|
| SMILES | CCCCCCCCNC(=O)OC |
Product Overview
methyl N-octylcarbamate (CAS 36598-10-4), with molecular formula C10H21NO2 and molecular weight 187.16 g/mol. IUPAC: methyl N-octylcarbamate.
Chemical Property Profile of methyl N-octylcarbamate
Property Insights of methyl N-octylcarbamate
The XLogP value of 2.7029 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-octylcarbamate. With a topological polar surface area (TPSA) of 38.33 Ų, methyl N-octylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl N-octylcarbamate has 1 hydrogen bond donor(s) and 2 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 methyl N-octylcarbamate?
The CAS number of methyl N-octylcarbamate is 36598-10-4.
What is the molecular formula of methyl N-octylcarbamate?
The molecular formula of methyl N-octylcarbamate is C10H21NO2.
What is the molecular weight of methyl N-octylcarbamate?
The molecular weight of methyl N-octylcarbamate is 187.16 g/mol.
Where can I buy methyl N-octylcarbamate?
You can request a quote for methyl N-octylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-octylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-octylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.