![Ethyl [4-(cyanomethyl)phenyl]carbamate structure](/static/products/165/165615-78-1.webp)
Ethyl [4-(cyanomethyl)phenyl]carbamate
TL;DR: Ethyl [4-(cyanomethyl)phenyl]carbamate (CAS 165615-78-1) is a chemical compound with molecular formula C11H12N2O2 and molecular weight 204.08987 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl N-[4-(cyanomethyl)phenyl]carbamate
Also Known As: Ethyl [4-(cyanomethyl)phenyl]carbamate, ethyl N-[4-(cyanomethyl)phenyl]carbamate, Carbamic acid, [4-(cyanomethyl)phenyl]-, ethyl ester
Technical Specifications
| Molecular Formula | C11H12N2O2 |
| Molecular Weight | 204.08987 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 62.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 204.08987 Da |
| Heavy Atoms | 15 |
| Complexity | 249.0 |
| SMILES | CCOC(=O)NC1=CC=C(C=C1)CC#N |
| InChIKey | IUSMEVOBKBQFSO-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl [4-(cyanomethyl)phenyl]carbamate
Property Insights of Ethyl [4-(cyanomethyl)phenyl]carbamate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl [4-(cyanomethyl)phenyl]carbamate. The TPSA of 62.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl [4-(cyanomethyl)phenyl]carbamate. Following Lipinski's Rule of Five, Ethyl [4-(cyanomethyl)phenyl]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
What is the CAS number of Ethyl [4-(cyanomethyl)phenyl]carbamate?
The CAS number of Ethyl [4-(cyanomethyl)phenyl]carbamate is 165615-78-1.
What is the molecular formula of Ethyl [4-(cyanomethyl)phenyl]carbamate?
The molecular formula of Ethyl [4-(cyanomethyl)phenyl]carbamate is C11H12N2O2.
What is the molecular weight of Ethyl [4-(cyanomethyl)phenyl]carbamate?
The molecular weight of Ethyl [4-(cyanomethyl)phenyl]carbamate is 204.08987 g/mol.
Where can I buy Ethyl [4-(cyanomethyl)phenyl]carbamate?
You can request a quote for Ethyl [4-(cyanomethyl)phenyl]carbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl [4-(cyanomethyl)phenyl]carbamate?
Yes, CoreyChem provides custom synthesis services for Ethyl [4-(cyanomethyl)phenyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.