3-甲基苯基丙基氨基甲酸酯
TL;DR: 3-甲基苯基丙基氨基甲酸酯 (CAS 60249-27-6) 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.
3-甲基苯基丙基氨基甲酸酯
(3-methylphenyl) N-propylcarbamate
Also Known As: metolcarb-Z, 3-methylphenyl propylcarbamate, m-tolyl n-propylcarbamate, 3-tolyl N-propylcarbamate, 3-methylphenyl N-propylcarbamate
| Molecular Formula | C11H15NO2 |
|---|---|
| Molecular Weight | 193.11 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 193.11028 |
| Heavy Atoms | 14 |
| Complexity | 182.0 |
Chemical Identifiers
| CAS Number | 60249-27-6 |
|---|---|
| SMILES | CCCNC(=O)OC1=CC=CC(=C1)C |
| InChIKey | SGUARVAWHMLPSY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-甲基苯基丙基氨基甲酸酯 (CAS 60249-27-6), with molecular formula C11H15NO2 and molecular weight 193.11 g/mol. IUPAC: (3-methylphenyl) N-propylcarbamate.
Chemical Property Profile of 3-甲基苯基丙基氨基甲酸酯
Property Insights of 3-甲基苯基丙基氨基甲酸酯
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-甲基苯基丙基氨基甲酸酯. With a topological polar surface area (TPSA) of 38.3 Ų, 3-甲基苯基丙基氨基甲酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-甲基苯基丙基氨基甲酸酯 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 3-甲基苯基丙基氨基甲酸酯?
The CAS number of 3-甲基苯基丙基氨基甲酸酯 is 60249-27-6.
What is the molecular formula of 3-甲基苯基丙基氨基甲酸酯?
The molecular formula of 3-甲基苯基丙基氨基甲酸酯 is C11H15NO2.
What is the molecular weight of 3-甲基苯基丙基氨基甲酸酯?
The molecular weight of 3-甲基苯基丙基氨基甲酸酯 is 193.11 g/mol.
Where can I buy 3-甲基苯基丙基氨基甲酸酯?
You can request a quote for 3-甲基苯基丙基氨基甲酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-甲基苯基丙基氨基甲酸酯?
Yes, KEHONG BIO provides custom synthesis services for 3-甲基苯基丙基氨基甲酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.