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Ethyl benzo[d][1,3]dioxol-2-ylidenecarbamate
TL;DR: Ethyl benzo[d][1,3]dioxol-2-ylidenecarbamate (CAS 324058-22-2) is a chemical compound with molecular formula C10H9NO4 and molecular weight 207.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-(1,3-benzodioxol-2-ylidene)carbamate
Also Known As: IFLab1_004256, IDI1_010011, ethyl 1,3-benzodioxol-2-ylidenecarbamate, ethyl benzo[d][1,3]dioxol-2-ylidenecarbamate, ethyl N-(1,3-benzodioxol-2-ylidene)carbamate
| Molecular Formula | C10H9NO4 |
|---|---|
| Molecular Weight | 207.05 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 57.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 207.05316 |
| Heavy Atoms | 15 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 324058-22-2 |
|---|---|
| SMILES | CCOC(=O)N=C1OC2=CC=CC=C2O1 |
| InChIKey | FSGXOUNWEDDLJZ-UHFFFAOYSA-N |
Product Overview
Ethyl benzo[d][1,3]dioxol-2-ylidenecarbamate (CAS 324058-22-2), with molecular formula C10H9NO4 and molecular weight 207.05 g/mol. IUPAC: ethyl N-(1,3-benzodioxol-2-ylidene)carbamate.
Chemical Property Profile of Ethyl benzo[d][1,3]dioxol-2-ylidenecarbamate
Property Insights of Ethyl benzo[d][1,3]dioxol-2-ylidenecarbamate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl benzo[d][1,3]dioxol-2-ylidenecarbamate. With a topological polar surface area (TPSA) of 57.1 Ų, Ethyl benzo[d][1,3]dioxol-2-ylidenecarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl benzo[d][1,3]dioxol-2-ylidenecarbamate 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 Ethyl benzo[d][1,3]dioxol-2-ylidenecarbamate?
The CAS number of Ethyl benzo[d][1,3]dioxol-2-ylidenecarbamate is 324058-22-2.
What is the molecular formula of Ethyl benzo[d][1,3]dioxol-2-ylidenecarbamate?
The molecular formula of Ethyl benzo[d][1,3]dioxol-2-ylidenecarbamate is C10H9NO4.
What is the molecular weight of Ethyl benzo[d][1,3]dioxol-2-ylidenecarbamate?
The molecular weight of Ethyl benzo[d][1,3]dioxol-2-ylidenecarbamate is 207.05 g/mol.
Where can I buy Ethyl benzo[d][1,3]dioxol-2-ylidenecarbamate?
You can request a quote for Ethyl benzo[d][1,3]dioxol-2-ylidenecarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl benzo[d][1,3]dioxol-2-ylidenecarbamate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl benzo[d][1,3]dioxol-2-ylidenecarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.