甲基氨基甲酸1,4-苯并二恶烷-5-基酯
TL;DR: 甲基氨基甲酸1,4-苯并二恶烷-5-基酯 (CAS 13792-21-7) is a chemical compound with molecular formula C10H11NO4 and molecular weight 209.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甲基氨基甲酸1,4-苯并二恶烷-5-基酯
2,3-dihydro-1,4-benzodioxin-5-yl N-methylcarbamate
Also Known As: Stauffer R-11163, ENT 27,362, 1,4-Benzodioxan-5-yl methylcarbamate, AI3-27362, R-11163
| Molecular Formula | C10H11NO4 |
|---|---|
| Molecular Weight | 209.07 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 56.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 209.0688 |
| Heavy Atoms | 15 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 13792-21-7 |
|---|---|
| SMILES | CNC(=O)OC1=CC=CC2=C1OCCO2 |
| InChIKey | XOVFOHFSGVFTPY-UHFFFAOYSA-N |
Product Overview
甲基氨基甲酸1,4-苯并二恶烷-5-基酯 (CAS 13792-21-7), with molecular formula C10H11NO4 and molecular weight 209.07 g/mol. IUPAC: 2,3-dihydro-1,4-benzodioxin-5-yl N-methylcarbamate.
Chemical Property Profile of 甲基氨基甲酸1,4-苯并二恶烷-5-基酯
Property Insights of 甲基氨基甲酸1,4-苯并二恶烷-5-基酯
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 甲基氨基甲酸1,4-苯并二恶烷-5-基酯. With a topological polar surface area (TPSA) of 56.8 Ų, 甲基氨基甲酸1,4-苯并二恶烷-5-基酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 甲基氨基甲酸1,4-苯并二恶烷-5-基酯 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 甲基氨基甲酸1,4-苯并二恶烷-5-基酯?
The CAS number of 甲基氨基甲酸1,4-苯并二恶烷-5-基酯 is 13792-21-7.
What is the molecular formula of 甲基氨基甲酸1,4-苯并二恶烷-5-基酯?
The molecular formula of 甲基氨基甲酸1,4-苯并二恶烷-5-基酯 is C10H11NO4.
What is the molecular weight of 甲基氨基甲酸1,4-苯并二恶烷-5-基酯?
The molecular weight of 甲基氨基甲酸1,4-苯并二恶烷-5-基酯 is 209.07 g/mol.
Where can I buy 甲基氨基甲酸1,4-苯并二恶烷-5-基酯?
You can request a quote for 甲基氨基甲酸1,4-苯并二恶烷-5-基酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲基氨基甲酸1,4-苯并二恶烷-5-基酯?
Yes, KEHONG BIO provides custom synthesis services for 甲基氨基甲酸1,4-苯并二恶烷-5-基酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.