1,3-Dicyclohexyl propanedioate
TL;DR: 1,3-Dicyclohexyl propanedioate (CAS 1152-57-4) is a chemical compound with molecular formula C15H24O4 and molecular weight 268.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dicyclohexyl propanedioate
Also Known As: Dicyclohexyl malonate, dicyclohexyl propanedioate, Dicyclohexyl malonate #, 1,3-Dicyclohexyl propanedioate, Propanedioic acid, dicyclohexyl ester
| Molecular Formula | C15H24O4 |
|---|---|
| Molecular Weight | 268.17 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 268.16745 |
| Heavy Atoms | 19 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 1152-57-4 |
|---|---|
| SMILES | C1CCC(CC1)OC(=O)CC(=O)OC2CCCCC2 |
| InChIKey | XNLLIRWJZUWAAJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Dicyclohexyl propanedioate (CAS 1152-57-4), with molecular formula C15H24O4 and molecular weight 268.17 g/mol. IUPAC: dicyclohexyl propanedioate.
Chemical Property Profile of 1,3-Dicyclohexyl propanedioate
Property Insights of 1,3-Dicyclohexyl propanedioate
The XLogP value of 3.8 indicates that 1,3-Dicyclohexyl propanedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 1,3-Dicyclohexyl propanedioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dicyclohexyl propanedioate 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 1,3-Dicyclohexyl propanedioate?
The CAS number of 1,3-Dicyclohexyl propanedioate is 1152-57-4.
What is the molecular formula of 1,3-Dicyclohexyl propanedioate?
The molecular formula of 1,3-Dicyclohexyl propanedioate is C15H24O4.
What is the molecular weight of 1,3-Dicyclohexyl propanedioate?
The molecular weight of 1,3-Dicyclohexyl propanedioate is 268.17 g/mol.
Where can I buy 1,3-Dicyclohexyl propanedioate?
You can request a quote for 1,3-Dicyclohexyl propanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dicyclohexyl propanedioate?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dicyclohexyl propanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.