3-胂基苯甲酸
TL;DR: 3-胂基苯甲酸 (CAS 62096-63-3) is a chemical compound with molecular formula C7H7AsO5 and molecular weight 245.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-胂基苯甲酸
3-arsonobenzoic acid
Also Known As: 3-arsonobenzoic acid, 3-arsono-benzoic acid, Benzoic acid,3-arsonoyl-, benzoic acid allylidenehydrazide
| Molecular Formula | C7H7AsO5 |
|---|---|
| Molecular Weight | 245.95 g/mol |
| LogP | -1.0542 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.95094 |
| Heavy Atoms | 13 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 62096-63-3 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[As](=O)(O)O)C(=O)O |
| InChIKey | CBQLLDMBISIJBK-UHFFFAOYSA-N |
Product Overview
3-胂基苯甲酸 (CAS 62096-63-3), with molecular formula C7H7AsO5 and molecular weight 245.95 g/mol. IUPAC: 3-arsonobenzoic acid.
Chemical Property Profile of 3-胂基苯甲酸
Property Insights of 3-胂基苯甲酸
The XLogP value of -1.0542 indicates that 3-胂基苯甲酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-胂基苯甲酸. Following Lipinski's Rule of Five, 3-胂基苯甲酸 has 3 hydrogen bond donor(s) and 5 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 3-胂基苯甲酸?
The CAS number of 3-胂基苯甲酸 is 62096-63-3.
What is the molecular formula of 3-胂基苯甲酸?
The molecular formula of 3-胂基苯甲酸 is C7H7AsO5.
What is the molecular weight of 3-胂基苯甲酸?
The molecular weight of 3-胂基苯甲酸 is 245.95 g/mol.
Where can I buy 3-胂基苯甲酸?
You can request a quote for 3-胂基苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-胂基苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 3-胂基苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.