(丁基苯基)氨基甲酸甲酯
TL;DR: (丁基苯基)氨基甲酸甲酯 (CAS 62604-09-5) is a chemical compound with molecular formula C12H17NO2 and molecular weight 207.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(丁基苯基)氨基甲酸甲酯
methyl N-butyl-N-phenylcarbamate
Also Known As: methyl N-butyl-N-phenylcarbamate, Methyl butyl(phenyl)carbamate, Carbamic acid, butylphenyl-, methyl ester
| Molecular Formula | C12H17NO2 |
|---|---|
| Molecular Weight | 207.13 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 207.12593 |
| Heavy Atoms | 15 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 62604-09-5 |
|---|---|
| SMILES | CCCCN(C1=CC=CC=C1)C(=O)OC |
| InChIKey | QQHJOLFBIPVCMS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(丁基苯基)氨基甲酸甲酯 (CAS 62604-09-5), with molecular formula C12H17NO2 and molecular weight 207.13 g/mol. IUPAC: methyl N-butyl-N-phenylcarbamate.
Chemical Property Profile of (丁基苯基)氨基甲酸甲酯
Property Insights of (丁基苯基)氨基甲酸甲酯
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (丁基苯基)氨基甲酸甲酯. With a topological polar surface area (TPSA) of 29.5 Ų, (丁基苯基)氨基甲酸甲酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (丁基苯基)氨基甲酸甲酯 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 (丁基苯基)氨基甲酸甲酯?
The CAS number of (丁基苯基)氨基甲酸甲酯 is 62604-09-5.
What is the molecular formula of (丁基苯基)氨基甲酸甲酯?
The molecular formula of (丁基苯基)氨基甲酸甲酯 is C12H17NO2.
What is the molecular weight of (丁基苯基)氨基甲酸甲酯?
The molecular weight of (丁基苯基)氨基甲酸甲酯 is 207.13 g/mol.
Where can I buy (丁基苯基)氨基甲酸甲酯?
You can request a quote for (丁基苯基)氨基甲酸甲酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (丁基苯基)氨基甲酸甲酯?
Yes, KEHONG BIO provides custom synthesis services for (丁基苯基)氨基甲酸甲酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.