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Acetic acid, chloro[(4-methoxyphenyl)hydrazono]-, methyl ester
TL;DR: Acetic acid, chloro[(4-methoxyphenyl)hydrazono]-, methyl ester (CAS 898787-06-9) 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.
methyl 2-chloro-2-[(4-methoxyphenyl)hydrazinylidene]acetate
Also Known As: Apixaban Impurity 105, Apixaban Impurity 233, 2,3-DIMETHYLBENZOYLACETONITRILE, Methyl chloro[(4-methoxyphenyl)hydrazono]acetate, Methyl (Z)-2-chloro-2-(2-(4-methoxyphenyl)hydrazono)acetate
| Molecular Formula | C10H11ClN2O3 |
|---|---|
| Molecular Weight | 242.05 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 59.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 242.04582 |
| Heavy Atoms | 16 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 898787-06-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NN=C(C(=O)OC)Cl |
| InChIKey | IPYYPYTUZHFTKC-UHFFFAOYSA-N |
Product Overview
Acetic acid, chloro[(4-methoxyphenyl)hydrazono]-, methyl ester (CAS 898787-06-9), with molecular formula C10H11ClN2O3 and molecular weight 242.05 g/mol. IUPAC: methyl 2-chloro-2-[(4-methoxyphenyl)hydrazinylidene]acetate.
Chemical Property Profile of Acetic acid, chloro[(4-methoxyphenyl)hydrazono]-, methyl ester
Property Insights of Acetic acid, chloro[(4-methoxyphenyl)hydrazono]-, methyl ester
The XLogP value of 3.7 indicates that Acetic acid, chloro[(4-methoxyphenyl)hydrazono]-, methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.9 Ų, Acetic acid, chloro[(4-methoxyphenyl)hydrazono]-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, chloro[(4-methoxyphenyl)hydrazono]-, methyl ester has 1 hydrogen bond donor(s) and 5 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 Acetic acid, chloro[(4-methoxyphenyl)hydrazono]-, methyl ester?
The CAS number of Acetic acid, chloro[(4-methoxyphenyl)hydrazono]-, methyl ester is 898787-06-9.
What is the molecular formula of Acetic acid, chloro[(4-methoxyphenyl)hydrazono]-, methyl ester?
The molecular formula of Acetic acid, chloro[(4-methoxyphenyl)hydrazono]-, methyl ester is C10H11ClN2O3.
What is the molecular weight of Acetic acid, chloro[(4-methoxyphenyl)hydrazono]-, methyl ester?
The molecular weight of Acetic acid, chloro[(4-methoxyphenyl)hydrazono]-, methyl ester is 242.05 g/mol.
Where can I buy Acetic acid, chloro[(4-methoxyphenyl)hydrazono]-, methyl ester?
You can request a quote for Acetic acid, chloro[(4-methoxyphenyl)hydrazono]-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, chloro[(4-methoxyphenyl)hydrazono]-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, chloro[(4-methoxyphenyl)hydrazono]-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.