Benzoic acid, 2-methoxy-, (2-chloro-1-iminoethyl)azanyl ester
TL;DR: Benzoic acid, 2-methoxy-, (2-chloro-1-iminoethyl)azanyl ester (CAS 255876-58-5) is a chemical compound with molecular formula C10H11ClN2O3 and molecular weight 242.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1-amino-2-chloroethylidene)amino] 2-methoxybenzoate
Also Known As: O1-(2-methoxybenzoyl)-2-chloroethanehydroximamide, [(1-amino-2-chloroethylidene)amino] 2-methoxybenzoate, [(E)-(1-amino-2-chloroethylidene)amino] 2-methoxybenzoate, Benzoic acid, 2-methoxy-, (2-chloro-1-iminoethyl)azanyl ester
| Molecular Formula | C10H11ClN2O3 |
|---|---|
| Molecular Weight | 242.05 g/mol |
| LogP | 1.363 |
| Topological Polar Surface Area | 73.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 242.04582 |
| Heavy Atoms | 16 |
| Complexity | 406.80554 |
Chemical Identifiers
| CAS Number | 255876-58-5 |
|---|---|
| SMILES | COC1=CC=CC=C1C(=O)ON=C(CCl)N |
Product Overview
Benzoic acid, 2-methoxy-, (2-chloro-1-iminoethyl)azanyl ester (CAS 255876-58-5), with molecular formula C10H11ClN2O3 and molecular weight 242.05 g/mol. IUPAC: [(1-amino-2-chloroethylidene)amino] 2-methoxybenzoate.
Chemical Property Profile of Benzoic acid, 2-methoxy-, (2-chloro-1-iminoethyl)azanyl ester
Property Insights of Benzoic acid, 2-methoxy-, (2-chloro-1-iminoethyl)azanyl ester
The XLogP value of 1.363 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 2-methoxy-, (2-chloro-1-iminoethyl)azanyl ester. The TPSA of 73.91 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 2-methoxy-, (2-chloro-1-iminoethyl)azanyl ester. Following Lipinski's Rule of Five, Benzoic acid, 2-methoxy-, (2-chloro-1-iminoethyl)azanyl ester has 1 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 Benzoic acid, 2-methoxy-, (2-chloro-1-iminoethyl)azanyl ester?
The CAS number of Benzoic acid, 2-methoxy-, (2-chloro-1-iminoethyl)azanyl ester is 255876-58-5.
What is the molecular formula of Benzoic acid, 2-methoxy-, (2-chloro-1-iminoethyl)azanyl ester?
The molecular formula of Benzoic acid, 2-methoxy-, (2-chloro-1-iminoethyl)azanyl ester is C10H11ClN2O3.
What is the molecular weight of Benzoic acid, 2-methoxy-, (2-chloro-1-iminoethyl)azanyl ester?
The molecular weight of Benzoic acid, 2-methoxy-, (2-chloro-1-iminoethyl)azanyl ester is 242.05 g/mol.
Where can I buy Benzoic acid, 2-methoxy-, (2-chloro-1-iminoethyl)azanyl ester?
You can request a quote for Benzoic acid, 2-methoxy-, (2-chloro-1-iminoethyl)azanyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-methoxy-, (2-chloro-1-iminoethyl)azanyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-methoxy-, (2-chloro-1-iminoethyl)azanyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.