Bis(1-hydroxypropan-2-yl) propanedioate
TL;DR: Bis(1-hydroxypropan-2-yl) propanedioate (CAS 20605-01-0) is a chemical compound with molecular formula C9H16O6 and molecular weight 220.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(1-hydroxypropan-2-yl) propanedioate
Also Known As: Diethyl bis(hydroxymethyl)malonate, Diethylbis(hydroxymethyl)malonate, bis(1-hydroxypropan-2-yl) propanedioate, Propanedioic acid, bis(hydroxymethyl)-, diethyl ester, Propanedioic acid, 2,2-bis(hydroxymethyl)-, 1,3-diethyl ester
| Molecular Formula | C9H16O6 |
|---|---|
| Molecular Weight | 220.09 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 220.09468 |
| Heavy Atoms | 15 |
| Complexity | 193.0 |
Chemical Identifiers
| CAS Number | 20605-01-0 |
|---|---|
| SMILES | CC(CO)OC(=O)CC(=O)OC(C)CO |
| InChIKey | NEGQQSPOAVKTOH-UHFFFAOYSA-N |
Product Overview
Bis(1-hydroxypropan-2-yl) propanedioate (CAS 20605-01-0), with molecular formula C9H16O6 and molecular weight 220.09 g/mol. IUPAC: bis(1-hydroxypropan-2-yl) propanedioate.
Chemical Property Profile of Bis(1-hydroxypropan-2-yl) propanedioate
Property Insights of Bis(1-hydroxypropan-2-yl) propanedioate
The XLogP value of -0.4 indicates that Bis(1-hydroxypropan-2-yl) propanedioate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Bis(1-hydroxypropan-2-yl) propanedioate. Following Lipinski's Rule of Five, Bis(1-hydroxypropan-2-yl) propanedioate has 2 hydrogen bond donor(s) and 6 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 Bis(1-hydroxypropan-2-yl) propanedioate?
The CAS number of Bis(1-hydroxypropan-2-yl) propanedioate is 20605-01-0.
What is the molecular formula of Bis(1-hydroxypropan-2-yl) propanedioate?
The molecular formula of Bis(1-hydroxypropan-2-yl) propanedioate is C9H16O6.
What is the molecular weight of Bis(1-hydroxypropan-2-yl) propanedioate?
The molecular weight of Bis(1-hydroxypropan-2-yl) propanedioate is 220.09 g/mol.
Where can I buy Bis(1-hydroxypropan-2-yl) propanedioate?
You can request a quote for Bis(1-hydroxypropan-2-yl) propanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(1-hydroxypropan-2-yl) propanedioate?
Yes, KEHONG BIO provides custom synthesis services for Bis(1-hydroxypropan-2-yl) propanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.