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Phenolphthalein structure
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Phenolphthalein

TL;DR: Phenolphthalein (CAS 77-09-8) is a chemical compound with molecular formula C20H14O4 and molecular weight 318.0892 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

Also Known As: phenolphthalein, Phthalimetten, Euchessina, Phenolax, Phthalin

CAS Number
77-09-8
Molecular Formula
C20H14O4
Molecular Weight
318.0892 g/mol
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Application Areas

Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (352 patents) Analytical Reagents (1108 patents) Biotechnology (1139 patents) Catalysts (396 patents) Coatings & Adhesives (572 patents)

Technical Specifications

Molecular FormulaC20H14O4
Molecular Weight318.0892 g/mol
XLogP3.6
Topological Polar Surface Area (TPSA)66.8 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors4
Rotatable Bonds2
Exact Mass318.0892 Da
Heavy Atoms24
Complexity438.0
Melting Point496 to 504 °F (NTP, 1992)
Density1.299 at 77 °F (NTP, 1992) - Denser than water; will sink
Vapor Pressure6.7X10-13 mm Hg @ 25 °C /Estimated/
Solubilityless than 1 mg/mL at 66 °F (NTP, 1992)
SMILESC1=CC=C2C(=C1)C(=O)OC2(C3=CC=C(C=C3)O)C4=CC=C(C=C4)O
InChIKeyKJFMBFZCATUALV-UHFFFAOYSA-N

Product Description

Applications: Phenolphthalein is used in polymer chemistry and functional materials synthesis, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

A polymer intermediate supplied by CoreyChem, Phenolphthalein (CAS 77-09-8) has the molecular formula C20H14O4 and a molecular weight of 318.09 g/mol. Reported properties include a density of 1.299 at 77 °F (NTP, 1992) - Denser than water; will sink g/cm³, a solubility: less than 1 mg/mL at 66 °F (NTP, 1992). Synonyms include phenolphthalein and Phthalimetten.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of Phenolphthalein

XLogP
3.6
TPSA (Topological Polar Surface Area)
66.8
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
2
Heavy Atoms
24
Complexity
438.0
Exact Mass
318.0892
Monoisotopic Mass
318.0892
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Phenolphthalein

The XLogP value of 3.6 indicates that Phenolphthalein is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenolphthalein. Following Lipinski's Rule of Five, Phenolphthalein has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Phenolphthalein?

The CAS number of Phenolphthalein is 77-09-8.

What is the molecular formula of Phenolphthalein?

The molecular formula of Phenolphthalein is C20H14O4.

What is the molecular weight of Phenolphthalein?

The molecular weight of Phenolphthalein is 318.0892 g/mol.

What are the applications of Phenolphthalein?

Phenolphthalein is used in polymer chemistry and functional materials synthesis, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg...

Where can I buy Phenolphthalein?

You can request a quote for Phenolphthalein directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Phenolphthalein?

Yes, CoreyChem provides custom synthesis services for Phenolphthalein and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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