4-(二甲氨基)水杨酸
TL;DR: 4-(二甲氨基)水杨酸 (CAS 23050-91-1) is a chemical compound with molecular formula C9H11NO3 and molecular weight 181.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(二甲氨基)水杨酸
4-(dimethylamino)-2-hydroxybenzoic acid
Also Known As: 4-(Dimethylamino)-2-hydroxybenzoic acid, 4-(Dimethylamino)salicylic acid, Benzoic acid, 4-(dimethylamino)-2-hydroxy-, 4-DIMETHYLAMINOSALICYLIC ACID, 4-Dimethylamino salicylic acid
| Molecular Formula | C9H11NO3 |
|---|---|
| Molecular Weight | 181.07 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 60.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 181.0739 |
| Heavy Atoms | 13 |
| Complexity | 193.0 |
Chemical Identifiers
| CAS Number | 23050-91-1 |
|---|---|
| SMILES | CN(C)C1=CC(=C(C=C1)C(=O)O)O |
| InChIKey | SJIDPEUJSIWFAE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(二甲氨基)水杨酸 (CAS 23050-91-1), with molecular formula C9H11NO3 and molecular weight 181.07 g/mol. IUPAC: 4-(dimethylamino)-2-hydroxybenzoic acid.
Chemical Property Profile of 4-(二甲氨基)水杨酸
Property Insights of 4-(二甲氨基)水杨酸
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(二甲氨基)水杨酸. The TPSA of 60.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(二甲氨基)水杨酸. Following Lipinski's Rule of Five, 4-(二甲氨基)水杨酸 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 4-(二甲氨基)水杨酸?
The CAS number of 4-(二甲氨基)水杨酸 is 23050-91-1.
What is the molecular formula of 4-(二甲氨基)水杨酸?
The molecular formula of 4-(二甲氨基)水杨酸 is C9H11NO3.
What is the molecular weight of 4-(二甲氨基)水杨酸?
The molecular weight of 4-(二甲氨基)水杨酸 is 181.07 g/mol.
Where can I buy 4-(二甲氨基)水杨酸?
You can request a quote for 4-(二甲氨基)水杨酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(二甲氨基)水杨酸?
Yes, KEHONG BIO provides custom synthesis services for 4-(二甲氨基)水杨酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.