1-Phenanthrenecarboxylic acid
TL;DR: 1-Phenanthrenecarboxylic acid (CAS 4614-69-1) is a chemical compound with molecular formula C15H10O2 and molecular weight 222.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenanthrene-1-carboxylic acid
Also Known As: 1-Phenanthrenecarboxylic acid, phenanthrene-1-carboxylic acid, Phenanthrenecarboxylic acid, phenanthrene-1-carboxylicacid, 1-aPhenanthrenecarboxylaic acid
| Molecular Formula | C15H10O2 |
|---|---|
| Molecular Weight | 222.07 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 222.06808 |
| Heavy Atoms | 17 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 4614-69-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=C2C=CC=C3C(=O)O |
| InChIKey | KFDKNTQGTAEZGC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Phenanthrenecarboxylic acid (CAS 4614-69-1), with molecular formula C15H10O2 and molecular weight 222.07 g/mol. IUPAC: phenanthrene-1-carboxylic acid.
Chemical Property Profile of 1-Phenanthrenecarboxylic acid
Property Insights of 1-Phenanthrenecarboxylic acid
The XLogP value of 4.3 indicates that 1-Phenanthrenecarboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 1-Phenanthrenecarboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenanthrenecarboxylic acid 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 1-Phenanthrenecarboxylic acid?
The CAS number of 1-Phenanthrenecarboxylic acid is 4614-69-1.
What is the molecular formula of 1-Phenanthrenecarboxylic acid?
The molecular formula of 1-Phenanthrenecarboxylic acid is C15H10O2.
What is the molecular weight of 1-Phenanthrenecarboxylic acid?
The molecular weight of 1-Phenanthrenecarboxylic acid is 222.07 g/mol.
Where can I buy 1-Phenanthrenecarboxylic acid?
You can request a quote for 1-Phenanthrenecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenanthrenecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenanthrenecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.