邻叔丁基苯酚二乙基氨基甲酸酯
TL;DR: 邻叔丁基苯酚二乙基氨基甲酸酯 (CAS 28460-08-4) is a chemical compound with molecular formula C15H23NO2 and molecular weight 249.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
邻叔丁基苯酚二乙基氨基甲酸酯
(2-tert-butylphenyl) N,N-diethylcarbamate
Also Known As: o-tert-Butylphenol diethylcarbamate, Phenol, o-tert-butyl-, diethylcarbamate, 2-tert-Butylphenyl diethylcarbamate, (2-tert-butylphenyl) N,N-diethylcarbamate, N,N-Diethylcarbamic acid 2-tert-butylphenyl ester
| Molecular Formula | C15H23NO2 |
|---|---|
| Molecular Weight | 249.17 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 249.17288 |
| Heavy Atoms | 18 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 28460-08-4 |
|---|---|
| SMILES | CCN(CC)C(=O)OC1=CC=CC=C1C(C)(C)C |
| InChIKey | ILLWWCPTMOEPDC-UHFFFAOYSA-N |
Product Overview
邻叔丁基苯酚二乙基氨基甲酸酯 (CAS 28460-08-4), with molecular formula C15H23NO2 and molecular weight 249.17 g/mol. IUPAC: (2-tert-butylphenyl) N,N-diethylcarbamate.
Chemical Property Profile of 邻叔丁基苯酚二乙基氨基甲酸酯
Property Insights of 邻叔丁基苯酚二乙基氨基甲酸酯
The XLogP value of 3.6 indicates that 邻叔丁基苯酚二乙基氨基甲酸酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 邻叔丁基苯酚二乙基氨基甲酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 邻叔丁基苯酚二乙基氨基甲酸酯 has 0 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 邻叔丁基苯酚二乙基氨基甲酸酯?
The CAS number of 邻叔丁基苯酚二乙基氨基甲酸酯 is 28460-08-4.
What is the molecular formula of 邻叔丁基苯酚二乙基氨基甲酸酯?
The molecular formula of 邻叔丁基苯酚二乙基氨基甲酸酯 is C15H23NO2.
What is the molecular weight of 邻叔丁基苯酚二乙基氨基甲酸酯?
The molecular weight of 邻叔丁基苯酚二乙基氨基甲酸酯 is 249.17 g/mol.
Where can I buy 邻叔丁基苯酚二乙基氨基甲酸酯?
You can request a quote for 邻叔丁基苯酚二乙基氨基甲酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 邻叔丁基苯酚二乙基氨基甲酸酯?
Yes, KEHONG BIO provides custom synthesis services for 邻叔丁基苯酚二乙基氨基甲酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.