(4-叔丁苯基)苯基氨基甲酸酯
TL;DR: (4-叔丁苯基)苯基氨基甲酸酯 (CAS 66018-74-4) is a chemical compound with molecular formula C17H19NO2 and molecular weight 269.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-叔丁苯基)苯基氨基甲酸酯
(4-tert-butylphenyl) N-phenylcarbamate
Also Known As: 4-tert-butylphenyl phenylcarbamate, NCIOpen2_004626, (4-tert-butylphenyl) N-phenylcarbamate, 4-tert-Butylphenyl-N-phenylcarbamate, Phenol,1-dimethylethyl)-, phenylcarbamate
| Molecular Formula | C17H19NO2 |
|---|---|
| Molecular Weight | 269.14 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 269.14157 |
| Heavy Atoms | 20 |
| Complexity | 307.0 |
Chemical Identifiers
| CAS Number | 66018-74-4 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)OC(=O)NC2=CC=CC=C2 |
| InChIKey | GNLRBUXTMCTMQI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(4-叔丁苯基)苯基氨基甲酸酯 (CAS 66018-74-4), with molecular formula C17H19NO2 and molecular weight 269.14 g/mol. IUPAC: (4-tert-butylphenyl) N-phenylcarbamate.
Chemical Property Profile of (4-叔丁苯基)苯基氨基甲酸酯
Property Insights of (4-叔丁苯基)苯基氨基甲酸酯
The XLogP value of 5.0 indicates that (4-叔丁苯基)苯基氨基甲酸酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, (4-叔丁苯基)苯基氨基甲酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-叔丁苯基)苯基氨基甲酸酯 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 (4-叔丁苯基)苯基氨基甲酸酯?
The CAS number of (4-叔丁苯基)苯基氨基甲酸酯 is 66018-74-4.
What is the molecular formula of (4-叔丁苯基)苯基氨基甲酸酯?
The molecular formula of (4-叔丁苯基)苯基氨基甲酸酯 is C17H19NO2.
What is the molecular weight of (4-叔丁苯基)苯基氨基甲酸酯?
The molecular weight of (4-叔丁苯基)苯基氨基甲酸酯 is 269.14 g/mol.
Where can I buy (4-叔丁苯基)苯基氨基甲酸酯?
You can request a quote for (4-叔丁苯基)苯基氨基甲酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-叔丁苯基)苯基氨基甲酸酯?
Yes, KEHONG BIO provides custom synthesis services for (4-叔丁苯基)苯基氨基甲酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.