4-乙酰氨基-2-氯苯甲酸
TL;DR: 4-乙酰氨基-2-氯苯甲酸 (CAS 38667-55-9) is a chemical compound with molecular formula C9H8ClNO3 and molecular weight 213.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-乙酰氨基-2-氯苯甲酸
4-acetamido-2-chlorobenzoic acid
Also Known As: 4-acetamido-2-chlorobenzoic acid, 4-(acetylamino)-2-chlorobenzoic acid, 2-chloro-4-acetamidobenzoic acid, 4-acetamido-2-chloro-benzoic Acid, 2-METHYL-PARA-AMINOBENZOICACID
| Molecular Formula | C9H8ClNO3 |
|---|---|
| Molecular Weight | 213.02 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 213.01927 |
| Heavy Atoms | 14 |
| Complexity | 244.0 |
Chemical Identifiers
| CAS Number | 38667-55-9 |
|---|---|
| SMILES | CC(=O)NC1=CC(=C(C=C1)C(=O)O)Cl |
| InChIKey | TZXJLFBEXYSTJG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-乙酰氨基-2-氯苯甲酸 (CAS 38667-55-9), with molecular formula C9H8ClNO3 and molecular weight 213.02 g/mol. IUPAC: 4-acetamido-2-chlorobenzoic acid.
Chemical Property Profile of 4-乙酰氨基-2-氯苯甲酸
Property Insights of 4-乙酰氨基-2-氯苯甲酸
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-乙酰氨基-2-氯苯甲酸. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-乙酰氨基-2-氯苯甲酸. Following Lipinski's Rule of Five, 4-乙酰氨基-2-氯苯甲酸 has 2 hydrogen bond donor(s) and 3 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-乙酰氨基-2-氯苯甲酸?
The CAS number of 4-乙酰氨基-2-氯苯甲酸 is 38667-55-9.
What is the molecular formula of 4-乙酰氨基-2-氯苯甲酸?
The molecular formula of 4-乙酰氨基-2-氯苯甲酸 is C9H8ClNO3.
What is the molecular weight of 4-乙酰氨基-2-氯苯甲酸?
The molecular weight of 4-乙酰氨基-2-氯苯甲酸 is 213.02 g/mol.
Where can I buy 4-乙酰氨基-2-氯苯甲酸?
You can request a quote for 4-乙酰氨基-2-氯苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-乙酰氨基-2-氯苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 4-乙酰氨基-2-氯苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.