Benzyl N-(4-cyanophenyl)carbamate
TL;DR: Benzyl N-(4-cyanophenyl)carbamate (CAS 849042-08-6) is a chemical compound with molecular formula C15H12N2O2 and molecular weight 252.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl N-(4-cyanophenyl)carbamate
Also Known As: Benzyl N-(4-cyanophenyl)carbamate
| Molecular Formula | C15H12N2O2 |
|---|---|
| Molecular Weight | 252.09 g/mol |
| LogP | 3.30698 |
| Topological Polar Surface Area | 62.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 252.08987 |
| Heavy Atoms | 19 |
| Complexity | 585.79266 |
Chemical Identifiers
| CAS Number | 849042-08-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)NC2=CC=C(C=C2)C#N |
Product Overview
Benzyl N-(4-cyanophenyl)carbamate (CAS 849042-08-6), with molecular formula C15H12N2O2 and molecular weight 252.09 g/mol. IUPAC: benzyl N-(4-cyanophenyl)carbamate.
Chemical Property Profile of Benzyl N-(4-cyanophenyl)carbamate
Property Insights of Benzyl N-(4-cyanophenyl)carbamate
The XLogP value of 3.30698 indicates that Benzyl N-(4-cyanophenyl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.12 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyl N-(4-cyanophenyl)carbamate. Following Lipinski's Rule of Five, Benzyl N-(4-cyanophenyl)carbamate has 1 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 Benzyl N-(4-cyanophenyl)carbamate?
The CAS number of Benzyl N-(4-cyanophenyl)carbamate is 849042-08-6.
What is the molecular formula of Benzyl N-(4-cyanophenyl)carbamate?
The molecular formula of Benzyl N-(4-cyanophenyl)carbamate is C15H12N2O2.
What is the molecular weight of Benzyl N-(4-cyanophenyl)carbamate?
The molecular weight of Benzyl N-(4-cyanophenyl)carbamate is 252.09 g/mol.
Where can I buy Benzyl N-(4-cyanophenyl)carbamate?
You can request a quote for Benzyl N-(4-cyanophenyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl N-(4-cyanophenyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl N-(4-cyanophenyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.