(4-Hydroxyphenyl)ferrocene
TL;DR: (4-Hydroxyphenyl)ferrocene (CAS 37847-87-3) is a chemical compound with molecular formula C16H14FeO and molecular weight 278.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclopenta-1,3-diene;4-cyclopenta-2,4-dien-1-ylphenol;iron(2+)
Also Known As: Askin, 4-Ferrocenylphenyl, 4-Ferrocenylphenol, (4-Hydroxyphenyl)ferrocene, Ferrocene, (4-hydroxyphenyl)-
| Molecular Formula | C16H14FeO |
|---|---|
| Molecular Weight | 278.04 g/mol |
| LogP | 4.1811 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 278.0394 |
| Heavy Atoms | 18 |
| Complexity | 142.0 |
Chemical Identifiers
| CAS Number | 37847-87-3 |
|---|---|
| SMILES | [CH-]1C=CC=C1.C1=C[C-](C=C1)C2=CC=C(C=C2)O.[Fe+2] |
| InChIKey | PBKSAWGZZXKEBJ-UHFFFAOYSA-N |
Product Overview
(4-Hydroxyphenyl)ferrocene (CAS 37847-87-3), with molecular formula C16H14FeO and molecular weight 278.04 g/mol. IUPAC: cyclopenta-1,3-diene;4-cyclopenta-2,4-dien-1-ylphenol;iron(2+).
Chemical Property Profile of (4-Hydroxyphenyl)ferrocene
Property Insights of (4-Hydroxyphenyl)ferrocene
The XLogP value of 4.1811 indicates that (4-Hydroxyphenyl)ferrocene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, (4-Hydroxyphenyl)ferrocene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Hydroxyphenyl)ferrocene has 1 hydrogen bond donor(s) and 3 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 (4-Hydroxyphenyl)ferrocene?
The CAS number of (4-Hydroxyphenyl)ferrocene is 37847-87-3.
What is the molecular formula of (4-Hydroxyphenyl)ferrocene?
The molecular formula of (4-Hydroxyphenyl)ferrocene is C16H14FeO.
What is the molecular weight of (4-Hydroxyphenyl)ferrocene?
The molecular weight of (4-Hydroxyphenyl)ferrocene is 278.04 g/mol.
Where can I buy (4-Hydroxyphenyl)ferrocene?
You can request a quote for (4-Hydroxyphenyl)ferrocene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Hydroxyphenyl)ferrocene?
Yes, KEHONG BIO provides custom synthesis services for (4-Hydroxyphenyl)ferrocene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.