2,2-二异丙基-1,3-丙二醇二氨基甲酸酯
TL;DR: 2,2-二异丙基-1,3-丙二醇二氨基甲酸酯 (CAS 25451-43-8) is a chemical compound with molecular formula C11H22N2O4 and molecular weight 246.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-二异丙基-1,3-丙二醇二氨基甲酸酯
[2-(carbamoyloxymethyl)-3-methyl-2-propan-2-ylbutyl] carbamate
Also Known As: 1,3-Propanediol, 2,2-diisopropyl-, dicarbamate, 2,2-Diisopropyl-1,3-propanedioldicarbamate, 1,3-propanediol, 2,2-bis(1-methylethyl)-, dicarbamate, Dicarbamic acid 2,2-diisopropyltrimethylene ester, [2-(carbamoyloxymethyl)-3-methyl-2-propan-2-ylbutyl] carbamate
| Molecular Formula | C11H22N2O4 |
|---|---|
| Molecular Weight | 246.16 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 246.15796 |
| Heavy Atoms | 17 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 25451-43-8 |
|---|---|
| SMILES | CC(C)C(COC(=O)N)(COC(=O)N)C(C)C |
| InChIKey | AAOQURPCQWSPJM-UHFFFAOYSA-N |
Product Overview
2,2-二异丙基-1,3-丙二醇二氨基甲酸酯 (CAS 25451-43-8), with molecular formula C11H22N2O4 and molecular weight 246.16 g/mol. IUPAC: [2-(carbamoyloxymethyl)-3-methyl-2-propan-2-ylbutyl] carbamate.
Chemical Property Profile of 2,2-二异丙基-1,3-丙二醇二氨基甲酸酯
Property Insights of 2,2-二异丙基-1,3-丙二醇二氨基甲酸酯
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-二异丙基-1,3-丙二醇二氨基甲酸酯. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2-二异丙基-1,3-丙二醇二氨基甲酸酯. Following Lipinski's Rule of Five, 2,2-二异丙基-1,3-丙二醇二氨基甲酸酯 has 2 hydrogen bond donor(s) and 4 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 2,2-二异丙基-1,3-丙二醇二氨基甲酸酯?
The CAS number of 2,2-二异丙基-1,3-丙二醇二氨基甲酸酯 is 25451-43-8.
What is the molecular formula of 2,2-二异丙基-1,3-丙二醇二氨基甲酸酯?
The molecular formula of 2,2-二异丙基-1,3-丙二醇二氨基甲酸酯 is C11H22N2O4.
What is the molecular weight of 2,2-二异丙基-1,3-丙二醇二氨基甲酸酯?
The molecular weight of 2,2-二异丙基-1,3-丙二醇二氨基甲酸酯 is 246.16 g/mol.
Where can I buy 2,2-二异丙基-1,3-丙二醇二氨基甲酸酯?
You can request a quote for 2,2-二异丙基-1,3-丙二醇二氨基甲酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-二异丙基-1,3-丙二醇二氨基甲酸酯?
Yes, KEHONG BIO provides custom synthesis services for 2,2-二异丙基-1,3-丙二醇二氨基甲酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.