2-戊基-1,3-丙二醇二氨基甲酸酯
TL;DR: 2-戊基-1,3-丙二醇二氨基甲酸酯 (CAS 25462-22-0) is a chemical compound with molecular formula C10H20N2O4 and molecular weight 232.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-戊基-1,3-丙二醇二氨基甲酸酯
2-(carbamoyloxymethyl)heptyl carbamate
Also Known As: 1,3-Propanediol, 2-pentyl-, dicarbamate, 2-Pentyl-1,3-propanediol dicarbamate, 2-isobutyl-propane-1,3-diol, KST-1B2404, 2-pentylpropane-1,3-diyl dicarbamate
| Molecular Formula | C10H20N2O4 |
|---|---|
| Molecular Weight | 232.14 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 232.1423 |
| Heavy Atoms | 16 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 25462-22-0 |
|---|---|
| SMILES | CCCCCC(COC(=O)N)COC(=O)N |
| InChIKey | JFBCNQQUKQOJPP-UHFFFAOYSA-N |
Product Overview
2-戊基-1,3-丙二醇二氨基甲酸酯 (CAS 25462-22-0), with molecular formula C10H20N2O4 and molecular weight 232.14 g/mol. IUPAC: 2-(carbamoyloxymethyl)heptyl carbamate.
Chemical Property Profile of 2-戊基-1,3-丙二醇二氨基甲酸酯
Property Insights of 2-戊基-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-戊基-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-戊基-1,3-丙二醇二氨基甲酸酯. Following Lipinski's Rule of Five, 2-戊基-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-戊基-1,3-丙二醇二氨基甲酸酯?
The CAS number of 2-戊基-1,3-丙二醇二氨基甲酸酯 is 25462-22-0.
What is the molecular formula of 2-戊基-1,3-丙二醇二氨基甲酸酯?
The molecular formula of 2-戊基-1,3-丙二醇二氨基甲酸酯 is C10H20N2O4.
What is the molecular weight of 2-戊基-1,3-丙二醇二氨基甲酸酯?
The molecular weight of 2-戊基-1,3-丙二醇二氨基甲酸酯 is 232.14 g/mol.
Where can I buy 2-戊基-1,3-丙二醇二氨基甲酸酯?
You can request a quote for 2-戊基-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-戊基-1,3-丙二醇二氨基甲酸酯?
Yes, KEHONG BIO provides custom synthesis services for 2-戊基-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.