N-(3,4-二乙氧基苯基)氨基甲酸叔丁酯
TL;DR: N-(3,4-二乙氧基苯基)氨基甲酸叔丁酯 (CAS 99612-45-0) is a chemical compound with molecular formula C15H23NO4 and molecular weight 281.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-二乙氧基苯基)氨基甲酸叔丁酯
tert-butyl N-(3,4-diethoxyphenyl)carbamate
Also Known As: Tert-butyl N-(3,4-diethoxyphenyl)carbamate, tert-Butyl (3,4-diethoxyphenyl)carbamate, Carbamic acid, (3,4-diethoxyphenyl)-, 1,1-dimethylethyl ester, N-(3,4-Diethoxyphenyl)carbamic acid tert-butyl ester, Carbamicacid,(3,4-diethoxyphenyl)-,1,1-dimethylethylester
| Molecular Formula | C15H23NO4 |
|---|---|
| Molecular Weight | 281.16 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 56.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 281.16272 |
| Heavy Atoms | 20 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 99612-45-0 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)NC(=O)OC(C)(C)C)OCC |
| InChIKey | MHNGMOOWWVYRQF-UHFFFAOYSA-N |
Product Overview
N-(3,4-二乙氧基苯基)氨基甲酸叔丁酯 (CAS 99612-45-0), with molecular formula C15H23NO4 and molecular weight 281.16 g/mol. IUPAC: tert-butyl N-(3,4-diethoxyphenyl)carbamate.
Chemical Property Profile of N-(3,4-二乙氧基苯基)氨基甲酸叔丁酯
Property Insights of N-(3,4-二乙氧基苯基)氨基甲酸叔丁酯
The XLogP value of 3.1 indicates that N-(3,4-二乙氧基苯基)氨基甲酸叔丁酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.8 Ų, N-(3,4-二乙氧基苯基)氨基甲酸叔丁酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3,4-二乙氧基苯基)氨基甲酸叔丁酯 has 1 hydrogen bond donor(s) and 4 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 N-(3,4-二乙氧基苯基)氨基甲酸叔丁酯?
The CAS number of N-(3,4-二乙氧基苯基)氨基甲酸叔丁酯 is 99612-45-0.
What is the molecular formula of N-(3,4-二乙氧基苯基)氨基甲酸叔丁酯?
The molecular formula of N-(3,4-二乙氧基苯基)氨基甲酸叔丁酯 is C15H23NO4.
What is the molecular weight of N-(3,4-二乙氧基苯基)氨基甲酸叔丁酯?
The molecular weight of N-(3,4-二乙氧基苯基)氨基甲酸叔丁酯 is 281.16 g/mol.
Where can I buy N-(3,4-二乙氧基苯基)氨基甲酸叔丁酯?
You can request a quote for N-(3,4-二乙氧基苯基)氨基甲酸叔丁酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,4-二乙氧基苯基)氨基甲酸叔丁酯?
Yes, KEHONG BIO provides custom synthesis services for N-(3,4-二乙氧基苯基)氨基甲酸叔丁酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.