苯乙酸铵盐(1:1)
TL;DR: 苯乙酸铵盐(1:1) (CAS 7188-16-1) is a chemical compound with molecular formula C8H11NO2 and molecular weight 153.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
苯乙酸铵盐(1:1)
azanium 2-phenylacetate
Also Known As: ammonium phenylacetate, Benzeneacetic acid, ammonium salt, ammonium salt, Ammonium phenyl acetate, azanium;2-phenylacetate
| Molecular Formula | C8H11NO2 |
|---|---|
| Molecular Weight | 153.08 g/mol |
| LogP | 0.36 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 153.07898 |
| Heavy Atoms | 11 |
| Complexity | 109.0 |
Chemical Identifiers
| CAS Number | 7188-16-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(=O)[O-].[NH4+] |
| InChIKey | PQILKFQDIYPBKI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
苯乙酸铵盐(1:1) (CAS 7188-16-1), with molecular formula C8H11NO2 and molecular weight 153.08 g/mol. IUPAC: azanium 2-phenylacetate.
Chemical Property Profile of 苯乙酸铵盐(1:1)
Property Insights of 苯乙酸铵盐(1:1)
The XLogP value of 0.36 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 苯乙酸铵盐(1:1). With a topological polar surface area (TPSA) of 41.1 Ų, 苯乙酸铵盐(1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 苯乙酸铵盐(1:1) 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 苯乙酸铵盐(1:1)?
The CAS number of 苯乙酸铵盐(1:1) is 7188-16-1.
What is the molecular formula of 苯乙酸铵盐(1:1)?
The molecular formula of 苯乙酸铵盐(1:1) is C8H11NO2.
What is the molecular weight of 苯乙酸铵盐(1:1)?
The molecular weight of 苯乙酸铵盐(1:1) is 153.08 g/mol.
Where can I buy 苯乙酸铵盐(1:1)?
You can request a quote for 苯乙酸铵盐(1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 苯乙酸铵盐(1:1)?
Yes, KEHONG BIO provides custom synthesis services for 苯乙酸铵盐(1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.