Carbamic acid, (1-phenylethyl)-, 3-methyloctyl ester
TL;DR: Carbamic acid, (1-phenylethyl)-, 3-methyloctyl ester (CAS 54833-47-5) is a chemical compound with molecular formula C18H29NO2 and molecular weight 291.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyloctyl N-(1-phenylethyl)carbamate
Also Known As: 3-Methyloctyl 1-phenylethylcarbamate, 3-methyloctyl N-(1-phenylethyl)carbamate, 3-Methyloctyl 1-phenylethylcarbamate #, (1-Phenylethyl)carbamic acid 3-methyloctyl ester, Carbamic acid, (1-phenylethyl)-, 3-methyloctyl ester
| Molecular Formula | C18H29NO2 |
|---|---|
| Molecular Weight | 291.22 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 291.21982 |
| Heavy Atoms | 21 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 54833-47-5 |
|---|---|
| SMILES | CCCCCC(C)CCOC(=O)NC(C)C1=CC=CC=C1 |
| InChIKey | JBZCOKIOBIAEOA-UHFFFAOYSA-N |
Product Overview
Carbamic acid, (1-phenylethyl)-, 3-methyloctyl ester (CAS 54833-47-5), with molecular formula C18H29NO2 and molecular weight 291.22 g/mol. IUPAC: 3-methyloctyl N-(1-phenylethyl)carbamate.
Chemical Property Profile of Carbamic acid, (1-phenylethyl)-, 3-methyloctyl ester
Property Insights of Carbamic acid, (1-phenylethyl)-, 3-methyloctyl ester
The XLogP value of 5.7 indicates that Carbamic acid, (1-phenylethyl)-, 3-methyloctyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, Carbamic acid, (1-phenylethyl)-, 3-methyloctyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, (1-phenylethyl)-, 3-methyloctyl ester has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Carbamic acid, (1-phenylethyl)-, 3-methyloctyl ester?
The CAS number of Carbamic acid, (1-phenylethyl)-, 3-methyloctyl ester is 54833-47-5.
What is the molecular formula of Carbamic acid, (1-phenylethyl)-, 3-methyloctyl ester?
The molecular formula of Carbamic acid, (1-phenylethyl)-, 3-methyloctyl ester is C18H29NO2.
What is the molecular weight of Carbamic acid, (1-phenylethyl)-, 3-methyloctyl ester?
The molecular weight of Carbamic acid, (1-phenylethyl)-, 3-methyloctyl ester is 291.22 g/mol.
Where can I buy Carbamic acid, (1-phenylethyl)-, 3-methyloctyl ester?
You can request a quote for Carbamic acid, (1-phenylethyl)-, 3-methyloctyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, (1-phenylethyl)-, 3-methyloctyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, (1-phenylethyl)-, 3-methyloctyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.