对苯二甲酸二丙酯
TL;DR: 对苯二甲酸二丙酯 (CAS 1962-74-9) is a chemical compound with molecular formula C14H18O4 and molecular weight 250.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
对苯二甲酸二丙酯
dipropyl benzene-1,4-dicarboxylate
Also Known As: Dipropyl terephthalate, Terephthalic acid, dipropyl ester, dipropyl benzene-1,4-dicarboxylate, Terephthalic acid dipropyl ester, 1,4-Benzenedicarboxylic acid, dipropyl ester
| Molecular Formula | C14H18O4 |
|---|---|
| Molecular Weight | 250.12 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 250.12051 |
| Heavy Atoms | 18 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 1962-74-9 |
|---|---|
| SMILES | CCCOC(=O)C1=CC=C(C=C1)C(=O)OCCC |
| InChIKey | GXJPKIGCMGAHTL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
对苯二甲酸二丙酯 (CAS 1962-74-9), with molecular formula C14H18O4 and molecular weight 250.12 g/mol. IUPAC: dipropyl benzene-1,4-dicarboxylate.
Chemical Property Profile of 对苯二甲酸二丙酯
Property Insights of 对苯二甲酸二丙酯
The XLogP value of 4.8 indicates that 对苯二甲酸二丙酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 对苯二甲酸二丙酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 对苯二甲酸二丙酯 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 对苯二甲酸二丙酯?
The CAS number of 对苯二甲酸二丙酯 is 1962-74-9.
What is the molecular formula of 对苯二甲酸二丙酯?
The molecular formula of 对苯二甲酸二丙酯 is C14H18O4.
What is the molecular weight of 对苯二甲酸二丙酯?
The molecular weight of 对苯二甲酸二丙酯 is 250.12 g/mol.
Where can I buy 对苯二甲酸二丙酯?
You can request a quote for 对苯二甲酸二丙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 对苯二甲酸二丙酯?
Yes, KEHONG BIO provides custom synthesis services for 对苯二甲酸二丙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.