1-(苯氨基)甲磺酸
TL;DR: 1-(苯氨基)甲磺酸 (CAS 103-06-0) is a chemical compound with molecular formula C7H9NO3S and molecular weight 187.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(苯氨基)甲磺酸
anilinomethanesulfonic acid
Also Known As: Anilinomethanesulfonic acid, Anilinomethanesulfonate, Aniline-omega-acid, 1-Tricosene, N-(Sulfomethyl)aniline
| Molecular Formula | C7H9NO3S |
|---|---|
| Molecular Weight | 187.03 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 74.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 187.03032 |
| Heavy Atoms | 12 |
| Complexity | 213.0 |
Chemical Identifiers
| CAS Number | 103-06-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)NCS(=O)(=O)O |
| InChIKey | QKZIVVMOMKTVIK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(苯氨基)甲磺酸 (CAS 103-06-0), with molecular formula C7H9NO3S and molecular weight 187.03 g/mol. IUPAC: anilinomethanesulfonic acid.
Chemical Property Profile of 1-(苯氨基)甲磺酸
Property Insights of 1-(苯氨基)甲磺酸
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(苯氨基)甲磺酸. The TPSA of 74.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(苯氨基)甲磺酸. Following Lipinski's Rule of Five, 1-(苯氨基)甲磺酸 has 2 hydrogen bond donor(s) and 4 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 1-(苯氨基)甲磺酸?
The CAS number of 1-(苯氨基)甲磺酸 is 103-06-0.
What is the molecular formula of 1-(苯氨基)甲磺酸?
The molecular formula of 1-(苯氨基)甲磺酸 is C7H9NO3S.
What is the molecular weight of 1-(苯氨基)甲磺酸?
The molecular weight of 1-(苯氨基)甲磺酸 is 187.03 g/mol.
Where can I buy 1-(苯氨基)甲磺酸?
You can request a quote for 1-(苯氨基)甲磺酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(苯氨基)甲磺酸?
Yes, KEHONG BIO provides custom synthesis services for 1-(苯氨基)甲磺酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.