5-氨基-2-氯苯甲酸硫酸盐(1:1)
TL;DR: 5-氨基-2-氯苯甲酸硫酸盐(1:1) (CAS 37984-73-9) is a chemical compound with molecular formula C7H8ClNO6S and molecular weight 268.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-氨基-2-氯苯甲酸硫酸盐(1:1)
(3-carboxy-4-chlorophenyl)azanium;hydrogen sulfate
Also Known As: 5-Amino-2-chlorobenzoic acid sulfate, AI3-33427, 5-AMINO-2-CHLOROBENZOICACIDSULFATE, Benzoic acid, 5-amino-2-chloro-, sulfate (1:1), (3-carboxy-4-chlorophenyl)azanium; hydrogen sulfate
| Molecular Formula | C7H8ClNO6S |
|---|---|
| Molecular Weight | 268.98 g/mol |
| LogP | -0.08 |
| Topological Polar Surface Area | 151.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 268.97607 |
| Heavy Atoms | 16 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 37984-73-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1[NH3+])C(=O)O)Cl.OS(=O)(=O)[O-] |
| InChIKey | OTRJMQKDZHIDKW-UHFFFAOYSA-N |
Product Overview
5-氨基-2-氯苯甲酸硫酸盐(1:1) (CAS 37984-73-9), with molecular formula C7H8ClNO6S and molecular weight 268.98 g/mol. IUPAC: (3-carboxy-4-chlorophenyl)azanium;hydrogen sulfate.
Chemical Property Profile of 5-氨基-2-氯苯甲酸硫酸盐(1:1)
Property Insights of 5-氨基-2-氯苯甲酸硫酸盐(1:1)
The XLogP value of -0.08 indicates that 5-氨基-2-氯苯甲酸硫酸盐(1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 151.0 Ų indicates high polarity, suggesting 5-氨基-2-氯苯甲酸硫酸盐(1:1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-氨基-2-氯苯甲酸硫酸盐(1:1) has 3 hydrogen bond donor(s) and 6 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 5-氨基-2-氯苯甲酸硫酸盐(1:1)?
The CAS number of 5-氨基-2-氯苯甲酸硫酸盐(1:1) is 37984-73-9.
What is the molecular formula of 5-氨基-2-氯苯甲酸硫酸盐(1:1)?
The molecular formula of 5-氨基-2-氯苯甲酸硫酸盐(1:1) is C7H8ClNO6S.
What is the molecular weight of 5-氨基-2-氯苯甲酸硫酸盐(1:1)?
The molecular weight of 5-氨基-2-氯苯甲酸硫酸盐(1:1) is 268.98 g/mol.
Where can I buy 5-氨基-2-氯苯甲酸硫酸盐(1:1)?
You can request a quote for 5-氨基-2-氯苯甲酸硫酸盐(1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-氨基-2-氯苯甲酸硫酸盐(1:1)?
Yes, KEHONG BIO provides custom synthesis services for 5-氨基-2-氯苯甲酸硫酸盐(1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.