Benzeneacetic acid, 2-(5-phenyl-1H-pyrazol-3-yl)-
TL;DR: Benzeneacetic acid, 2-(5-phenyl-1H-pyrazol-3-yl)- (CAS 104907-27-9) is a chemical compound with molecular formula C17H14N2O2 and molecular weight 278.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(3-phenyl-1H-pyrazol-5-yl)phenyl]acetic acid
Also Known As: Benzeneacetic acid, 2-(5-phenyl-1H-pyrazol-3-yl)-, 2-[2-(3-phenyl-1H-pyrazol-5-yl)phenyl]acetic acid, 2-(2-(5-Phenyl-1H-pyrazol-3-yl)phenyl)acetic acid, 2-(3-Phenyl-1H-pyrazol-5-yl)benzeneacetic acid, [2-(3-phenyl-1h-pyrazol-5-yl)phenyl]acetic acid
| Molecular Formula | C17H14N2O2 |
|---|---|
| Molecular Weight | 278.11 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 66.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 278.10553 |
| Heavy Atoms | 21 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 104907-27-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NNC(=C2)C3=CC=CC=C3CC(=O)O |
| InChIKey | MVHIYGQQENACMD-UHFFFAOYSA-N |
Product Overview
Benzeneacetic acid, 2-(5-phenyl-1H-pyrazol-3-yl)- (CAS 104907-27-9), with molecular formula C17H14N2O2 and molecular weight 278.11 g/mol. IUPAC: 2-[2-(3-phenyl-1H-pyrazol-5-yl)phenyl]acetic acid.
Chemical Property Profile of Benzeneacetic acid, 2-(5-phenyl-1H-pyrazol-3-yl)-
Property Insights of Benzeneacetic acid, 2-(5-phenyl-1H-pyrazol-3-yl)-
The XLogP value of 3.0 indicates that Benzeneacetic acid, 2-(5-phenyl-1H-pyrazol-3-yl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzeneacetic acid, 2-(5-phenyl-1H-pyrazol-3-yl)-. Following Lipinski's Rule of Five, Benzeneacetic acid, 2-(5-phenyl-1H-pyrazol-3-yl)- has 2 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 Benzeneacetic acid, 2-(5-phenyl-1H-pyrazol-3-yl)-?
The CAS number of Benzeneacetic acid, 2-(5-phenyl-1H-pyrazol-3-yl)- is 104907-27-9.
What is the molecular formula of Benzeneacetic acid, 2-(5-phenyl-1H-pyrazol-3-yl)-?
The molecular formula of Benzeneacetic acid, 2-(5-phenyl-1H-pyrazol-3-yl)- is C17H14N2O2.
What is the molecular weight of Benzeneacetic acid, 2-(5-phenyl-1H-pyrazol-3-yl)-?
The molecular weight of Benzeneacetic acid, 2-(5-phenyl-1H-pyrazol-3-yl)- is 278.11 g/mol.
Where can I buy Benzeneacetic acid, 2-(5-phenyl-1H-pyrazol-3-yl)-?
You can request a quote for Benzeneacetic acid, 2-(5-phenyl-1H-pyrazol-3-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneacetic acid, 2-(5-phenyl-1H-pyrazol-3-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzeneacetic acid, 2-(5-phenyl-1H-pyrazol-3-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.