对甲基苯胺基甲酸异丙酯
TL;DR: 对甲基苯胺基甲酸异丙酯 (CAS 36613-26-0) 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.
对甲基苯胺基甲酸异丙酯
propan-2-yl N-(4-methylphenyl)carbamate
Also Known As: Isopropyl p-methylcarbanilate, Isopropyl p-tolylcarbamate, propan-2-yl N-(4-methylphenyl)carbamate, isopropyl N-(4-methylphenyl)carbamate, ISOPROPYL N-(P-TOLYL)CARBAMATE
| Molecular Formula | C11H15NO2 |
|---|---|
| Molecular Weight | 193.11 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 193.11028 |
| Heavy Atoms | 14 |
| Complexity | 184.0 |
Chemical Identifiers
| CAS Number | 36613-26-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)OC(C)C |
| InChIKey | OCJDJZUWXVNOQW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
对甲基苯胺基甲酸异丙酯 (CAS 36613-26-0), with molecular formula C11H15NO2 and molecular weight 193.11 g/mol. IUPAC: propan-2-yl N-(4-methylphenyl)carbamate.
Chemical Property Profile of 对甲基苯胺基甲酸异丙酯
Property Insights of 对甲基苯胺基甲酸异丙酯
The XLogP value of 3.0 indicates that 对甲基苯胺基甲酸异丙酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, 对甲基苯胺基甲酸异丙酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 对甲基苯胺基甲酸异丙酯 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 对甲基苯胺基甲酸异丙酯?
The CAS number of 对甲基苯胺基甲酸异丙酯 is 36613-26-0.
What is the molecular formula of 对甲基苯胺基甲酸异丙酯?
The molecular formula of 对甲基苯胺基甲酸异丙酯 is C11H15NO2.
What is the molecular weight of 对甲基苯胺基甲酸异丙酯?
The molecular weight of 对甲基苯胺基甲酸异丙酯 is 193.11 g/mol.
Where can I buy 对甲基苯胺基甲酸异丙酯?
You can request a quote for 对甲基苯胺基甲酸异丙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 对甲基苯胺基甲酸异丙酯?
Yes, KEHONG BIO provides custom synthesis services for 对甲基苯胺基甲酸异丙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.