针枞酚
TL;DR: 针枞酚 (CAS 99-93-4) is a chemical compound with molecular formula C8H8O2 and molecular weight 136.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
针枞酚
1-(4-hydroxyphenyl)ethanone
Also Known As: 4'-Hydroxyacetophenone, 4-Hydroxyacetophenone, 1-(4-Hydroxyphenyl)ethanone, 4-Acetylphenol, P-HYDROXYACETOPHENONE
| Molecular Formula | C8H8O2 |
|---|---|
| Molecular Weight | 136.05 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 136.05243 |
| Heavy Atoms | 10 |
| Complexity | 123.0 |
| Solubility | Practically insoluble or insoluble in water |
| Vapor Pressure | 0.00748 [mmHg] |
Chemical Identifiers
| CAS Number | 99-93-4 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)O |
| InChIKey | TXFPEBPIARQUIG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
针枞酚 (CAS 99-93-4), with molecular formula C8H8O2 and molecular weight 136.05 g/mol. IUPAC: 1-(4-hydroxyphenyl)ethanone.
Chemical Property Profile of 针枞酚
Property Insights of 针枞酚
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 针枞酚. With a topological polar surface area (TPSA) of 37.3 Ų, 针枞酚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 针枞酚 has 1 hydrogen bond donor(s) and 2 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 针枞酚?
The CAS number of 针枞酚 is 99-93-4.
What is the molecular formula of 针枞酚?
The molecular formula of 针枞酚 is C8H8O2.
What is the molecular weight of 针枞酚?
The molecular weight of 针枞酚 is 136.05 g/mol.
Where can I buy 针枞酚?
You can request a quote for 针枞酚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 针枞酚?
Yes, KEHONG BIO provides custom synthesis services for 针枞酚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.