Carbamic acid, dimethyl-, 2,2-dimethyl-1,3-benzodioxol-4-yl ester
TL;DR: Carbamic acid, dimethyl-, 2,2-dimethyl-1,3-benzodioxol-4-yl ester (CAS 22791-27-1) is a chemical compound with molecular formula C12H15NO4 and molecular weight 237.10011 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2,2-dimethyl-1,3-benzodioxol-4-yl) N,N-dimethylcarbamate
Also Known As: Dimethylcarbamic acid 2,2-dimethyl-1,3-benzodioxol-4-yl ester, CARBAMIC ACID, DIMETHYL-, 2,2-DIMETHYL-1,3-BENZODIOXOL-4-YL ESTER, 2,2-Dimethyl-2H-1,3-benzodioxol-4-yl dimethylcarbamate, (2,2-dimethyl-1,3-benzodioxol-4-yl) N,N-dimethylcarbamate
Technical Specifications
| Molecular Formula | C12H15NO4 |
| Molecular Weight | 237.10011 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.10011 Da |
| Heavy Atoms | 17 |
| Complexity | 303.0 |
| SMILES | CC1(OC2=C(O1)C(=CC=C2)OC(=O)N(C)C)C |
| InChIKey | SVHOZKTXNBRNOQ-UHFFFAOYSA-N |
Chemical Property Profile of Carbamic acid, dimethyl-, 2,2-dimethyl-1,3-benzodioxol-4-yl ester
Property Insights of Carbamic acid, dimethyl-, 2,2-dimethyl-1,3-benzodioxol-4-yl ester
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, dimethyl-, 2,2-dimethyl-1,3-benzodioxol-4-yl ester. With a topological polar surface area (TPSA) of 48.0 Ų, Carbamic acid, dimethyl-, 2,2-dimethyl-1,3-benzodioxol-4-yl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, dimethyl-, 2,2-dimethyl-1,3-benzodioxol-4-yl ester 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
What is the CAS number of Carbamic acid, dimethyl-, 2,2-dimethyl-1,3-benzodioxol-4-yl ester?
The CAS number of Carbamic acid, dimethyl-, 2,2-dimethyl-1,3-benzodioxol-4-yl ester is 22791-27-1.
What is the molecular formula of Carbamic acid, dimethyl-, 2,2-dimethyl-1,3-benzodioxol-4-yl ester?
The molecular formula of Carbamic acid, dimethyl-, 2,2-dimethyl-1,3-benzodioxol-4-yl ester is C12H15NO4.
What is the molecular weight of Carbamic acid, dimethyl-, 2,2-dimethyl-1,3-benzodioxol-4-yl ester?
The molecular weight of Carbamic acid, dimethyl-, 2,2-dimethyl-1,3-benzodioxol-4-yl ester is 237.10011 g/mol.
Where can I buy Carbamic acid, dimethyl-, 2,2-dimethyl-1,3-benzodioxol-4-yl ester?
You can request a quote for Carbamic acid, dimethyl-, 2,2-dimethyl-1,3-benzodioxol-4-yl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Carbamic acid, dimethyl-, 2,2-dimethyl-1,3-benzodioxol-4-yl ester?
Yes, CoreyChem provides custom synthesis services for Carbamic acid, dimethyl-, 2,2-dimethyl-1,3-benzodioxol-4-yl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.