2-tert-Butyl-2-methyl-2H-1,3-benzodioxol-4-yl hydrogen methylcarbonimidate
TL;DR: 2-tert-Butyl-2-methyl-2H-1,3-benzodioxol-4-yl hydrogen methylcarbonimidate (CAS 22791-19-1) is a chemical compound with molecular formula C14H19NO4 and molecular weight 265.1314 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-tert-butyl-2-methyl-1,3-benzodioxol-4-yl) N-methylcarbamate
Also Known As: 2-(1,1-Dimethylethyl)-2-methyl-1,3-benzodioxol-4-ol methylcarbamate, 1,3-BENZODIOXOL-4-OL, 2-(1,1-DIMETHYLETHYL)-2-METHYL-, METHYLCARBAMATE, 2-tert-Butyl-2-methyl-2H-1,3-benzodioxol-4-yl hydrogen methylcarbonimidate, (2-tert-butyl-2-methyl-1,3-benzodioxol-4-yl) N-methylcarbamate
Technical Specifications
| Molecular Formula | C14H19NO4 |
| Molecular Weight | 265.1314 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 56.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 265.1314 Da |
| Heavy Atoms | 19 |
| Complexity | 352.0 |
| SMILES | CC1(OC2=C(O1)C(=CC=C2)OC(=O)NC)C(C)(C)C |
| InChIKey | ILSUYTFZLSJCID-UHFFFAOYSA-N |
Chemical Property Profile of 2-tert-Butyl-2-methyl-2H-1,3-benzodioxol-4-yl hydrogen methylcarbonimidate
Property Insights of 2-tert-Butyl-2-methyl-2H-1,3-benzodioxol-4-yl hydrogen methylcarbonimidate
The XLogP value of 3.1 indicates that 2-tert-Butyl-2-methyl-2H-1,3-benzodioxol-4-yl hydrogen methylcarbonimidate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.8 Ų, 2-tert-Butyl-2-methyl-2H-1,3-benzodioxol-4-yl hydrogen methylcarbonimidate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-tert-Butyl-2-methyl-2H-1,3-benzodioxol-4-yl hydrogen methylcarbonimidate 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
What is the CAS number of 2-tert-Butyl-2-methyl-2H-1,3-benzodioxol-4-yl hydrogen methylcarbonimidate?
The CAS number of 2-tert-Butyl-2-methyl-2H-1,3-benzodioxol-4-yl hydrogen methylcarbonimidate is 22791-19-1.
What is the molecular formula of 2-tert-Butyl-2-methyl-2H-1,3-benzodioxol-4-yl hydrogen methylcarbonimidate?
The molecular formula of 2-tert-Butyl-2-methyl-2H-1,3-benzodioxol-4-yl hydrogen methylcarbonimidate is C14H19NO4.
What is the molecular weight of 2-tert-Butyl-2-methyl-2H-1,3-benzodioxol-4-yl hydrogen methylcarbonimidate?
The molecular weight of 2-tert-Butyl-2-methyl-2H-1,3-benzodioxol-4-yl hydrogen methylcarbonimidate is 265.1314 g/mol.
Where can I buy 2-tert-Butyl-2-methyl-2H-1,3-benzodioxol-4-yl hydrogen methylcarbonimidate?
You can request a quote for 2-tert-Butyl-2-methyl-2H-1,3-benzodioxol-4-yl hydrogen methylcarbonimidate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-tert-Butyl-2-methyl-2H-1,3-benzodioxol-4-yl hydrogen methylcarbonimidate?
Yes, CoreyChem provides custom synthesis services for 2-tert-Butyl-2-methyl-2H-1,3-benzodioxol-4-yl hydrogen methylcarbonimidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.