![4-[(2-氯乙基)氨基]-2-羟基苯甲酸 structure](/static/products/913/91360-95-1.png)
4-[(2-氯乙基)氨基]-2-羟基苯甲酸
TL;DR: 4-[(2-氯乙基)氨基]-2-羟基苯甲酸 (CAS 91360-95-1) is a chemical compound with molecular formula C9H10ClNO3 and molecular weight 215.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2-氯乙基)氨基]-2-羟基苯甲酸
4-(2-chloroethylamino)-2-hydroxybenzoic acid
Also Known As: 5-Iodo-2-methyl-benzothiazole, 4-[(2-chloroethyl)amino]-2-hydroxybenzoic acid, 4-(2-chloroethylamino)-2-hydroxybenzoic acid, 4-(2-chloroethylamino)-2-hydroxy-benzoic acid
| Molecular Formula | C9H10ClNO3 |
|---|---|
| Molecular Weight | 215.03 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 69.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 215.03493 |
| Heavy Atoms | 14 |
| Complexity | 200.0 |
Chemical Identifiers
| CAS Number | 91360-95-1 |
|---|---|
| SMILES | C1=CC(=C(C=C1NCCCl)O)C(=O)O |
| InChIKey | VYDUCLVBTOAWBD-UHFFFAOYSA-N |
Product Overview
4-[(2-氯乙基)氨基]-2-羟基苯甲酸 (CAS 91360-95-1), with molecular formula C9H10ClNO3 and molecular weight 215.03 g/mol. IUPAC: 4-(2-chloroethylamino)-2-hydroxybenzoic acid.
Chemical Property Profile of 4-[(2-氯乙基)氨基]-2-羟基苯甲酸
Property Insights of 4-[(2-氯乙基)氨基]-2-羟基苯甲酸
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(2-氯乙基)氨基]-2-羟基苯甲酸. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(2-氯乙基)氨基]-2-羟基苯甲酸. Following Lipinski's Rule of Five, 4-[(2-氯乙基)氨基]-2-羟基苯甲酸 has 3 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-[(2-氯乙基)氨基]-2-羟基苯甲酸?
The CAS number of 4-[(2-氯乙基)氨基]-2-羟基苯甲酸 is 91360-95-1.
What is the molecular formula of 4-[(2-氯乙基)氨基]-2-羟基苯甲酸?
The molecular formula of 4-[(2-氯乙基)氨基]-2-羟基苯甲酸 is C9H10ClNO3.
What is the molecular weight of 4-[(2-氯乙基)氨基]-2-羟基苯甲酸?
The molecular weight of 4-[(2-氯乙基)氨基]-2-羟基苯甲酸 is 215.03 g/mol.
Where can I buy 4-[(2-氯乙基)氨基]-2-羟基苯甲酸?
You can request a quote for 4-[(2-氯乙基)氨基]-2-羟基苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(2-氯乙基)氨基]-2-羟基苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 4-[(2-氯乙基)氨基]-2-羟基苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.