![[(Z)-(1-amino-2-chloro-ethylidene)amino] benzoate structure](/static/products/2558/255876-57-4.webp)
[(Z)-(1-amino-2-chloro-ethylidene)amino] benzoate
TL;DR: [(Z)-(1-amino-2-chloro-ethylidene)amino] benzoate (CAS 255876-57-4) is a chemical compound with molecular formula C9H9ClN2O2 and molecular weight 212.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1-amino-2-chloroethylidene)amino] benzoate
Also Known As: O1-benzoyl-2-chloroethanehydroximamide, [(1-amino-2-chloroethylidene)amino] benzoate, [(1-amino-2-chloro-ethylidene)amino] benzoate, [(Z)-(1-amino-2-chloro-ethylidene)amino] benzoate
| Molecular Formula | C9H9ClN2O2 |
|---|---|
| Molecular Weight | 212.04 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 64.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 212.03525 |
| Heavy Atoms | 14 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 255876-57-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)ON=C(CCl)N |
| InChIKey | HOUUAIGUOYWWNK-UHFFFAOYSA-N |
Product Overview
[(Z)-(1-amino-2-chloro-ethylidene)amino] benzoate (CAS 255876-57-4), with molecular formula C9H9ClN2O2 and molecular weight 212.04 g/mol. IUPAC: [(1-amino-2-chloroethylidene)amino] benzoate.
Chemical Property Profile of [(Z)-(1-amino-2-chloro-ethylidene)amino] benzoate
Property Insights of [(Z)-(1-amino-2-chloro-ethylidene)amino] benzoate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(Z)-(1-amino-2-chloro-ethylidene)amino] benzoate. The TPSA of 64.7 Ų falls within the moderate polarity range, balancing permeability and solubility for [(Z)-(1-amino-2-chloro-ethylidene)amino] benzoate. Following Lipinski's Rule of Five, [(Z)-(1-amino-2-chloro-ethylidene)amino] benzoate has 1 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 [(Z)-(1-amino-2-chloro-ethylidene)amino] benzoate?
The CAS number of [(Z)-(1-amino-2-chloro-ethylidene)amino] benzoate is 255876-57-4.
What is the molecular formula of [(Z)-(1-amino-2-chloro-ethylidene)amino] benzoate?
The molecular formula of [(Z)-(1-amino-2-chloro-ethylidene)amino] benzoate is C9H9ClN2O2.
What is the molecular weight of [(Z)-(1-amino-2-chloro-ethylidene)amino] benzoate?
The molecular weight of [(Z)-(1-amino-2-chloro-ethylidene)amino] benzoate is 212.04 g/mol.
Where can I buy [(Z)-(1-amino-2-chloro-ethylidene)amino] benzoate?
You can request a quote for [(Z)-(1-amino-2-chloro-ethylidene)amino] benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(Z)-(1-amino-2-chloro-ethylidene)amino] benzoate?
Yes, KEHONG BIO provides custom synthesis services for [(Z)-(1-amino-2-chloro-ethylidene)amino] benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.