1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, isobutylcarbamate
TL;DR: 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, isobutylcarbamate (CAS 63991-94-6) is a chemical compound with molecular formula C15H30N2O4 and molecular weight 302.22055 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-methyl-2-(2-methylpropylcarbamoyloxymethyl)pentyl] N,N-dimethylcarbamate
Also Known As: 2-Methyl-2-propyl-1,3-propanediol dimethylcarbamate isobutylcarbamate, 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, isobutylcarbamate, 2-{[(dimethylcarbamoyl)oxy]methyl}-2-methylpentyl isobutylcarbamate, N,N,2-Trimethyl-N'-isobutyl-2-propyl-1,3-dicarbamoyloxy-propan, [2-methyl-2-(2-methylpropylcarbamoyloxymethyl)pentyl] N,N-dimethylcarbamate
Technical Specifications
| Molecular Formula | C15H30N2O4 |
| Molecular Weight | 302.22055 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 67.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 302.22055 Da |
| Heavy Atoms | 21 |
| Complexity | 332.0 |
| SMILES | CCCC(C)(COC(=O)NCC(C)C)COC(=O)N(C)C |
| InChIKey | NKIJDWIHUKJRGW-UHFFFAOYSA-N |
Chemical Property Profile of 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, isobutylcarbamate
Property Insights of 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, isobutylcarbamate
The XLogP value of 3.3 indicates that 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, isobutylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, isobutylcarbamate. Following Lipinski's Rule of Five, 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, isobutylcarbamate 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 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, isobutylcarbamate?
The CAS number of 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, isobutylcarbamate is 63991-94-6.
What is the molecular formula of 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, isobutylcarbamate?
The molecular formula of 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, isobutylcarbamate is C15H30N2O4.
What is the molecular weight of 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, isobutylcarbamate?
The molecular weight of 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, isobutylcarbamate is 302.22055 g/mol.
Where can I buy 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, isobutylcarbamate?
You can request a quote for 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, isobutylcarbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, isobutylcarbamate?
Yes, CoreyChem provides custom synthesis services for 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, isobutylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.