1,3-Benzodioxol-5-ylmethyl 2-methoxyphenylcarbamate
TL;DR: 1,3-Benzodioxol-5-ylmethyl 2-methoxyphenylcarbamate (CAS 6860-92-0) is a chemical compound with molecular formula C16H15NO5 and molecular weight 301.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-benzodioxol-5-ylmethyl N-(2-methoxyphenyl)carbamate
Also Known As: Carbanilicacid,o-methoxy-,piperonylester, 1,3-benzodioxol-5-ylmethyl 2-methoxyphenylcarbamate, 1,3-benzodioxol-5-ylmethyl N-(2-methoxyphenyl)carbamate, Benzo[1,3]dioxol-5-ylmethyl N-(2-methoxyphenyl)carbamate, Carbanilic acid, o-methoxy-, piperonyl ester (7CI, 8CI)
| Molecular Formula | C16H15NO5 |
|---|---|
| Molecular Weight | 301.10 g/mol |
| LogP | 3.1726 |
| Topological Polar Surface Area | 66.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 301.09503 |
| Heavy Atoms | 22 |
| Complexity | 685.98645 |
Chemical Identifiers
| CAS Number | 6860-92-0 |
|---|---|
| SMILES | COC1=CC=CC=C1NC(=O)OCC2=CC3=C(C=C2)OCO3 |
Product Overview
1,3-Benzodioxol-5-ylmethyl 2-methoxyphenylcarbamate (CAS 6860-92-0), with molecular formula C16H15NO5 and molecular weight 301.10 g/mol. IUPAC: 1,3-benzodioxol-5-ylmethyl N-(2-methoxyphenyl)carbamate.
Chemical Property Profile of 1,3-Benzodioxol-5-ylmethyl 2-methoxyphenylcarbamate
Property Insights of 1,3-Benzodioxol-5-ylmethyl 2-methoxyphenylcarbamate
The XLogP value of 3.1726 indicates that 1,3-Benzodioxol-5-ylmethyl 2-methoxyphenylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.02 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Benzodioxol-5-ylmethyl 2-methoxyphenylcarbamate. Following Lipinski's Rule of Five, 1,3-Benzodioxol-5-ylmethyl 2-methoxyphenylcarbamate has 1 hydrogen bond donor(s) and 5 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-ylmethyl 2-methoxyphenylcarbamate?
The CAS number of 1,3-Benzodioxol-5-ylmethyl 2-methoxyphenylcarbamate is 6860-92-0.
What is the molecular formula of 1,3-Benzodioxol-5-ylmethyl 2-methoxyphenylcarbamate?
The molecular formula of 1,3-Benzodioxol-5-ylmethyl 2-methoxyphenylcarbamate is C16H15NO5.
What is the molecular weight of 1,3-Benzodioxol-5-ylmethyl 2-methoxyphenylcarbamate?
The molecular weight of 1,3-Benzodioxol-5-ylmethyl 2-methoxyphenylcarbamate is 301.10 g/mol.
Where can I buy 1,3-Benzodioxol-5-ylmethyl 2-methoxyphenylcarbamate?
You can request a quote for 1,3-Benzodioxol-5-ylmethyl 2-methoxyphenylcarbamate 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-ylmethyl 2-methoxyphenylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Benzodioxol-5-ylmethyl 2-methoxyphenylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.