Phenol, 3-amino-, 1-(hydrogen sulfate)
TL;DR: Phenol, 3-amino-, 1-(hydrogen sulfate) (CAS 1206680-42-3) is a chemical compound with molecular formula C6H7NO4S and molecular weight 189.00958 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3-aminophenyl) hydrogen sulfate
Also Known As: 3-Aminophenol hemisulfate, m-Aminophenol sulfate, 1-amino-3-sulfooxy-benzene, (3-aminophenyl) hydrogen sulfate, 3-aminophenyl hydrogen sulfate
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H7NO4S |
| Molecular Weight | 189.00958 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 98.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 189.00958 Da |
| Heavy Atoms | 12 |
| Complexity | 232.0 |
| SMILES | C1=CC(=CC(=C1)OS(=O)(=O)O)N |
| InChIKey | IWAJNGNXXQKWON-UHFFFAOYSA-N |
Chemical Property Profile of Phenol, 3-amino-, 1-(hydrogen sulfate)
Property Insights of Phenol, 3-amino-, 1-(hydrogen sulfate)
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenol, 3-amino-, 1-(hydrogen sulfate). The TPSA of 98.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenol, 3-amino-, 1-(hydrogen sulfate). Following Lipinski's Rule of Five, Phenol, 3-amino-, 1-(hydrogen sulfate) has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Phenol, 3-amino-, 1-(hydrogen sulfate)?
The CAS number of Phenol, 3-amino-, 1-(hydrogen sulfate) is 1206680-42-3.
What is the molecular formula of Phenol, 3-amino-, 1-(hydrogen sulfate)?
The molecular formula of Phenol, 3-amino-, 1-(hydrogen sulfate) is C6H7NO4S.
What is the molecular weight of Phenol, 3-amino-, 1-(hydrogen sulfate)?
The molecular weight of Phenol, 3-amino-, 1-(hydrogen sulfate) is 189.00958 g/mol.
Where can I buy Phenol, 3-amino-, 1-(hydrogen sulfate)?
You can request a quote for Phenol, 3-amino-, 1-(hydrogen sulfate) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Phenol, 3-amino-, 1-(hydrogen sulfate)?
Yes, CoreyChem provides custom synthesis services for Phenol, 3-amino-, 1-(hydrogen sulfate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.