Ethyl naphthalen-1-ylcarbamate
TL;DR: Ethyl naphthalen-1-ylcarbamate (CAS 52827-02-8) is a chemical compound with molecular formula C13H13NO2 and molecular weight 215.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-naphthalen-1-ylcarbamate
Also Known As: ethyl naphthalen-1-ylcarbamate, naphthylurethane, ethyl 1-naphthylcarbamate, ethyl N-(naphthalen-1-yl)carbamate, ethyl N-naphthalen-1-ylcarbamate
| Molecular Formula | C13H13NO2 |
|---|---|
| Molecular Weight | 215.09 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 215.09464 |
| Heavy Atoms | 16 |
| Complexity | 242.0 |
Chemical Identifiers
| CAS Number | 52827-02-8 |
|---|---|
| SMILES | CCOC(=O)NC1=CC=CC2=CC=CC=C21 |
| InChIKey | ARNSTSIXMKZQBC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl naphthalen-1-ylcarbamate (CAS 52827-02-8), with molecular formula C13H13NO2 and molecular weight 215.09 g/mol. IUPAC: ethyl N-naphthalen-1-ylcarbamate.
Chemical Property Profile of Ethyl naphthalen-1-ylcarbamate
Property Insights of Ethyl naphthalen-1-ylcarbamate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl naphthalen-1-ylcarbamate. With a topological polar surface area (TPSA) of 38.3 Ų, Ethyl naphthalen-1-ylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl naphthalen-1-ylcarbamate 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 Ethyl naphthalen-1-ylcarbamate?
The CAS number of Ethyl naphthalen-1-ylcarbamate is 52827-02-8.
What is the molecular formula of Ethyl naphthalen-1-ylcarbamate?
The molecular formula of Ethyl naphthalen-1-ylcarbamate is C13H13NO2.
What is the molecular weight of Ethyl naphthalen-1-ylcarbamate?
The molecular weight of Ethyl naphthalen-1-ylcarbamate is 215.09 g/mol.
Where can I buy Ethyl naphthalen-1-ylcarbamate?
You can request a quote for Ethyl naphthalen-1-ylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl naphthalen-1-ylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl naphthalen-1-ylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.