Dimethyl 2,3-diphenylbutanedioate
TL;DR: Dimethyl 2,3-diphenylbutanedioate (CAS 19020-59-8) is a chemical compound with molecular formula C18H18O4 and molecular weight 298.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2,3-diphenylbutanedioate
Also Known As: dimethyl 2,3-diphenylbutanedioate, Dimethyl 2,3-Diphenylsuccinate, 2,3-Diphenylbutanedioic acid dimethyl ester, 2,3-Diphenylsuccinic acid dimethyl ester, Butanedioic acid, 2,3-diphenyl-, dimethyl ester
| Molecular Formula | C18H18O4 |
|---|---|
| Molecular Weight | 298.12 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 298.1205 |
| Heavy Atoms | 22 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 19020-59-8 |
|---|---|
| SMILES | COC(=O)C(C1=CC=CC=C1)C(C2=CC=CC=C2)C(=O)OC |
| InChIKey | JFIQBXWLKNJROM-UHFFFAOYSA-N |
Product Overview
Dimethyl 2,3-diphenylbutanedioate (CAS 19020-59-8), with molecular formula C18H18O4 and molecular weight 298.12 g/mol. IUPAC: dimethyl 2,3-diphenylbutanedioate.
Chemical Property Profile of Dimethyl 2,3-diphenylbutanedioate
Property Insights of Dimethyl 2,3-diphenylbutanedioate
The XLogP value of 3.3 indicates that Dimethyl 2,3-diphenylbutanedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Dimethyl 2,3-diphenylbutanedioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethyl 2,3-diphenylbutanedioate 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 Dimethyl 2,3-diphenylbutanedioate?
The CAS number of Dimethyl 2,3-diphenylbutanedioate is 19020-59-8.
What is the molecular formula of Dimethyl 2,3-diphenylbutanedioate?
The molecular formula of Dimethyl 2,3-diphenylbutanedioate is C18H18O4.
What is the molecular weight of Dimethyl 2,3-diphenylbutanedioate?
The molecular weight of Dimethyl 2,3-diphenylbutanedioate is 298.12 g/mol.
Where can I buy Dimethyl 2,3-diphenylbutanedioate?
You can request a quote for Dimethyl 2,3-diphenylbutanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 2,3-diphenylbutanedioate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 2,3-diphenylbutanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.