1,3-Benzodioxol-5-yl dimethylcarbamate
TL;DR: 1,3-Benzodioxol-5-yl dimethylcarbamate (CAS 2594-29-8) 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.
1,3-benzodioxol-5-yl N,N-dimethylcarbamate
Also Known As: 1,3-benzodioxol-5-yl dimethylcarbamate, 1,3-benzodioxol-5-yl N,N-dimethylcarbamate, 2H-1,3-benzodioxol-5-yl dimethylcarbamate, AP-124/43383520, 2H-benzo[3,4-d]1,3-dioxolan-5-yloxy-N,N-dimethylcarboxamide
| Molecular Formula | C10H11NO4 |
|---|---|
| Molecular Weight | 209.07 g/mol |
| LogP | 1.4757 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 209.0688 |
| Heavy Atoms | 15 |
| Complexity | 389.00882 |
Chemical Identifiers
| CAS Number | 2594-29-8 |
|---|---|
| SMILES | CN(C)C(=O)OC1=CC2=C(C=C1)OCO2 |
Product Overview
1,3-Benzodioxol-5-yl dimethylcarbamate (CAS 2594-29-8), with molecular formula C10H11NO4 and molecular weight 209.07 g/mol. IUPAC: 1,3-benzodioxol-5-yl N,N-dimethylcarbamate.
Chemical Property Profile of 1,3-Benzodioxol-5-yl dimethylcarbamate
Property Insights of 1,3-Benzodioxol-5-yl dimethylcarbamate
The XLogP value of 1.4757 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Benzodioxol-5-yl dimethylcarbamate. With a topological polar surface area (TPSA) of 48.0 Ų, 1,3-Benzodioxol-5-yl dimethylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Benzodioxol-5-yl dimethylcarbamate has 0 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 1,3-Benzodioxol-5-yl dimethylcarbamate?
The CAS number of 1,3-Benzodioxol-5-yl dimethylcarbamate is 2594-29-8.
What is the molecular formula of 1,3-Benzodioxol-5-yl dimethylcarbamate?
The molecular formula of 1,3-Benzodioxol-5-yl dimethylcarbamate is C10H11NO4.
What is the molecular weight of 1,3-Benzodioxol-5-yl dimethylcarbamate?
The molecular weight of 1,3-Benzodioxol-5-yl dimethylcarbamate is 209.07 g/mol.
Where can I buy 1,3-Benzodioxol-5-yl dimethylcarbamate?
You can request a quote for 1,3-Benzodioxol-5-yl dimethylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Benzodioxol-5-yl dimethylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Benzodioxol-5-yl dimethylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.