间叔丁基苯酚氨基甲酸酯
TL;DR: 间叔丁基苯酚氨基甲酸酯 (CAS 28338-29-6) is a chemical compound with molecular formula C11H15NO2 and molecular weight 193.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
间叔丁基苯酚氨基甲酸酯
(3-tert-butylphenyl) carbamate
Also Known As: m-tert-Butylphenol carbamate, Phenol, m-tert-butyl-, carbamate, 3-tert-butylphenyl carbamate, (3-tert-butylphenyl)carbamate, (3-tert-butylphenyl) carbamate
| Molecular Formula | C11H15NO2 |
|---|---|
| Molecular Weight | 193.11 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 193.11028 |
| Heavy Atoms | 14 |
| Complexity | 208.0 |
Chemical Identifiers
| CAS Number | 28338-29-6 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=CC=C1)OC(=O)N |
| InChIKey | JWSPGCGMDZWYHQ-UHFFFAOYSA-N |
Product Overview
间叔丁基苯酚氨基甲酸酯 (CAS 28338-29-6), with molecular formula C11H15NO2 and molecular weight 193.11 g/mol. IUPAC: (3-tert-butylphenyl) carbamate.
Chemical Property Profile of 间叔丁基苯酚氨基甲酸酯
Property Insights of 间叔丁基苯酚氨基甲酸酯
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 间叔丁基苯酚氨基甲酸酯. With a topological polar surface area (TPSA) of 52.3 Ų, 间叔丁基苯酚氨基甲酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 间叔丁基苯酚氨基甲酸酯 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 间叔丁基苯酚氨基甲酸酯?
The CAS number of 间叔丁基苯酚氨基甲酸酯 is 28338-29-6.
What is the molecular formula of 间叔丁基苯酚氨基甲酸酯?
The molecular formula of 间叔丁基苯酚氨基甲酸酯 is C11H15NO2.
What is the molecular weight of 间叔丁基苯酚氨基甲酸酯?
The molecular weight of 间叔丁基苯酚氨基甲酸酯 is 193.11 g/mol.
Where can I buy 间叔丁基苯酚氨基甲酸酯?
You can request a quote for 间叔丁基苯酚氨基甲酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 间叔丁基苯酚氨基甲酸酯?
Yes, KEHONG BIO provides custom synthesis services for 间叔丁基苯酚氨基甲酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.