2-Ethyl-2-methyl-2H-1,3-benzodioxol-4-yl acetyl(methyl)carbamate
TL;DR: 2-Ethyl-2-methyl-2H-1,3-benzodioxol-4-yl acetyl(methyl)carbamate (CAS 2610-59-5) is a chemical compound with molecular formula C14H17NO5 and molecular weight 279.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-ethyl-2-methyl-1,3-benzodioxol-4-yl) N-acetyl-N-methylcarbamate
Also Known As: Acetylmethylcarbamic acid 2-ethyl-2-methyl-1,3-benzodioxol-4-yl ester, 2-ethyl-2-methyl-1,3-benzodioxol-4-yl acetyl(methyl)carbamate, Carbamic acid, acetylmethyl-, 2-ethyl-2-methyl-1,3-benzodioxol-4-yl ester, (2-ethyl-2-methyl-1,3-benzodioxol-4-yl) N-acetyl-N-methylcarbamate, 2-Ethyl-2-methyl-2H-1,3-benzodioxol-4-yl acetyl(methyl)carbamate
| Molecular Formula | C14H17NO5 |
|---|---|
| Molecular Weight | 279.11 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 65.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 279.1107 |
| Heavy Atoms | 20 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 2610-59-5 |
|---|---|
| SMILES | CCC1(OC2=C(O1)C(=CC=C2)OC(=O)N(C)C(=O)C)C |
| InChIKey | YNGLPKKOWRUTDJ-UHFFFAOYSA-N |
Product Overview
2-Ethyl-2-methyl-2H-1,3-benzodioxol-4-yl acetyl(methyl)carbamate (CAS 2610-59-5), with molecular formula C14H17NO5 and molecular weight 279.11 g/mol. IUPAC: (2-ethyl-2-methyl-1,3-benzodioxol-4-yl) N-acetyl-N-methylcarbamate.
Chemical Property Profile of 2-Ethyl-2-methyl-2H-1,3-benzodioxol-4-yl acetyl(methyl)carbamate
Property Insights of 2-Ethyl-2-methyl-2H-1,3-benzodioxol-4-yl acetyl(methyl)carbamate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Ethyl-2-methyl-2H-1,3-benzodioxol-4-yl acetyl(methyl)carbamate. The TPSA of 65.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Ethyl-2-methyl-2H-1,3-benzodioxol-4-yl acetyl(methyl)carbamate. Following Lipinski's Rule of Five, 2-Ethyl-2-methyl-2H-1,3-benzodioxol-4-yl acetyl(methyl)carbamate has 0 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 2-Ethyl-2-methyl-2H-1,3-benzodioxol-4-yl acetyl(methyl)carbamate?
The CAS number of 2-Ethyl-2-methyl-2H-1,3-benzodioxol-4-yl acetyl(methyl)carbamate is 2610-59-5.
What is the molecular formula of 2-Ethyl-2-methyl-2H-1,3-benzodioxol-4-yl acetyl(methyl)carbamate?
The molecular formula of 2-Ethyl-2-methyl-2H-1,3-benzodioxol-4-yl acetyl(methyl)carbamate is C14H17NO5.
What is the molecular weight of 2-Ethyl-2-methyl-2H-1,3-benzodioxol-4-yl acetyl(methyl)carbamate?
The molecular weight of 2-Ethyl-2-methyl-2H-1,3-benzodioxol-4-yl acetyl(methyl)carbamate is 279.11 g/mol.
Where can I buy 2-Ethyl-2-methyl-2H-1,3-benzodioxol-4-yl acetyl(methyl)carbamate?
You can request a quote for 2-Ethyl-2-methyl-2H-1,3-benzodioxol-4-yl acetyl(methyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethyl-2-methyl-2H-1,3-benzodioxol-4-yl acetyl(methyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethyl-2-methyl-2H-1,3-benzodioxol-4-yl acetyl(methyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.