1-(4-methylphenyl)ethyl N-phenylcarbamate
TL;DR: 1-(4-methylphenyl)ethyl N-phenylcarbamate (CAS 5787-69-9) is a chemical compound with molecular formula C16H17NO2 and molecular weight 255.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylphenyl)ethyl N-phenylcarbamate
Also Known As: 1-(4-methylphenyl)ethyl N-phenylcarbamate, 1-(4-Methylphenyl)ethyl phenylcarbamate, Benzenemethanol,4-dimethyl-, phenylcarbamate, Benzyl alcohol,.alpha.-dimethyl-, carbanilate, p,.alpha.-Dimethylbenzyl alcohol phenylurethan
| Molecular Formula | C16H17NO2 |
|---|---|
| Molecular Weight | 255.13 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 255.12593 |
| Heavy Atoms | 19 |
| Complexity | 278.0 |
Chemical Identifiers
| CAS Number | 5787-69-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(C)OC(=O)NC2=CC=CC=C2 |
| InChIKey | GIUFOURUWAGYTP-UHFFFAOYSA-N |
Product Overview
1-(4-methylphenyl)ethyl N-phenylcarbamate (CAS 5787-69-9), with molecular formula C16H17NO2 and molecular weight 255.13 g/mol. IUPAC: 1-(4-methylphenyl)ethyl N-phenylcarbamate.
Chemical Property Profile of 1-(4-methylphenyl)ethyl N-phenylcarbamate
Property Insights of 1-(4-methylphenyl)ethyl N-phenylcarbamate
The XLogP value of 3.8 indicates that 1-(4-methylphenyl)ethyl N-phenylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, 1-(4-methylphenyl)ethyl N-phenylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-methylphenyl)ethyl N-phenylcarbamate 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 1-(4-methylphenyl)ethyl N-phenylcarbamate?
The CAS number of 1-(4-methylphenyl)ethyl N-phenylcarbamate is 5787-69-9.
What is the molecular formula of 1-(4-methylphenyl)ethyl N-phenylcarbamate?
The molecular formula of 1-(4-methylphenyl)ethyl N-phenylcarbamate is C16H17NO2.
What is the molecular weight of 1-(4-methylphenyl)ethyl N-phenylcarbamate?
The molecular weight of 1-(4-methylphenyl)ethyl N-phenylcarbamate is 255.13 g/mol.
Where can I buy 1-(4-methylphenyl)ethyl N-phenylcarbamate?
You can request a quote for 1-(4-methylphenyl)ethyl N-phenylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-methylphenyl)ethyl N-phenylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-methylphenyl)ethyl N-phenylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.