(2-Methyl-3-propanoyloxypropyl) propanoate
TL;DR: (2-Methyl-3-propanoyloxypropyl) propanoate (CAS 54932-83-1) is a chemical compound with molecular formula C10H18O4 and molecular weight 202.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methyl-3-propanoyloxypropyl) propanoate
Also Known As: 1, 2-methyl-, dipropanoate, (2-methyl-3-propanoyloxypropyl) propanoate, 2-methylpropane-1,3-diyl dipropionate, 1,3-Propanediol, 2-methyl-, dipropanoate, 2-methyl-1,3-bis-propionyloxy-propane
| Molecular Formula | C10H18O4 |
|---|---|
| Molecular Weight | 202.12 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 202.12051 |
| Heavy Atoms | 14 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 54932-83-1 |
|---|---|
| SMILES | CCC(=O)OCC(C)COC(=O)CC |
| InChIKey | LCHSSYJMPNSABL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(2-Methyl-3-propanoyloxypropyl) propanoate (CAS 54932-83-1), with molecular formula C10H18O4 and molecular weight 202.12 g/mol. IUPAC: (2-methyl-3-propanoyloxypropyl) propanoate.
Chemical Property Profile of (2-Methyl-3-propanoyloxypropyl) propanoate
Property Insights of (2-Methyl-3-propanoyloxypropyl) propanoate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Methyl-3-propanoyloxypropyl) propanoate. With a topological polar surface area (TPSA) of 52.6 Ų, (2-Methyl-3-propanoyloxypropyl) propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Methyl-3-propanoyloxypropyl) propanoate 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
Frequently Asked Questions
What is the CAS number of (2-Methyl-3-propanoyloxypropyl) propanoate?
The CAS number of (2-Methyl-3-propanoyloxypropyl) propanoate is 54932-83-1.
What is the molecular formula of (2-Methyl-3-propanoyloxypropyl) propanoate?
The molecular formula of (2-Methyl-3-propanoyloxypropyl) propanoate is C10H18O4.
What is the molecular weight of (2-Methyl-3-propanoyloxypropyl) propanoate?
The molecular weight of (2-Methyl-3-propanoyloxypropyl) propanoate is 202.12 g/mol.
Where can I buy (2-Methyl-3-propanoyloxypropyl) propanoate?
You can request a quote for (2-Methyl-3-propanoyloxypropyl) propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Methyl-3-propanoyloxypropyl) propanoate?
Yes, KEHONG BIO provides custom synthesis services for (2-Methyl-3-propanoyloxypropyl) propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.