RefChem:70705
TL;DR: RefChem:70705 (CAS 67874-86-6) is a chemical compound with molecular formula C26H29NO5 and molecular weight 435.20456 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,3-bis(4-hydroxyphenyl)-2-benzofuran-1-one;2-(diethylamino)ethanol
Also Known As: Phenolphthalein diethylaminoethanol salt, KST-1B7472, 1(3H)-Isobenzofuranone, 3,3-bis(4-hydroxyphenyl)-, compd. with 2-(diethylamino)ethanol (1:1), 1(3h)-isobenzofuranone, 3,3-bis(4-hydroxyphenyl)-, compd. with 2-(diethylamino)ethanol(1:1), 3,3-Bis(4-hydroxyphenyl)phthalide, compound with 2-(diethylamino)ethanol (1:1)
Technical Specifications
| Molecular Formula | C26H29NO5 |
| Molecular Weight | 435.20456 g/mol |
| XLogP | 3.88 |
| Topological Polar Surface Area (TPSA) | 90.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 435.20456 Da |
| Heavy Atoms | 32 |
| Complexity | 482.0 |
| SMILES | CCN(CC)CCO.C1=CC=C2C(=C1)C(=O)OC2(C3=CC=C(C=C3)O)C4=CC=C(C=C4)O |
| InChIKey | VAZCKEBLMFALSW-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:70705
Property Insights of RefChem:70705
The XLogP value of 3.88 indicates that RefChem:70705 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.2 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:70705. Following Lipinski's Rule of Five, RefChem:70705 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:70705?
The CAS number of RefChem:70705 is 67874-86-6.
What is the molecular formula of RefChem:70705?
The molecular formula of RefChem:70705 is C26H29NO5.
What is the molecular weight of RefChem:70705?
The molecular weight of RefChem:70705 is 435.20456 g/mol.
Where can I buy RefChem:70705?
You can request a quote for RefChem:70705 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:70705?
Yes, CoreyChem provides custom synthesis services for RefChem:70705 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.