Acetic acid, phenyl-, (2-chloro-1-(chloromethyl)ethylidene)hydrazide
TL;DR: Acetic acid, phenyl-, (2-chloro-1-(chloromethyl)ethylidene)hydrazide (CAS 7696-87-9) is a chemical compound with molecular formula C11H12Cl2N2O and molecular weight 258.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-dichloropropan-2-ylideneamino)-2-phenylacetamide
Also Known As: Acetic acid, phenyl-, (1,3-dichloroisopropylidene)hydrazide, ACETIC ACID, PHENYL-, (2-CHLORO-1-(CHLOROMETHYL)ETHYLIDENE)HYDRAZIDE, N-(1,3-dichloropropan-2-ylideneamino)-2-phenylacetamide, N'-[2-Chloro-1- ethylidene]-2-phenylacetohydrazide, Phenylacetic acid (p-chloro-1-(chloromethyl)ethylidene) hydrazide
| Molecular Formula | C11H12Cl2N2O |
|---|---|
| Molecular Weight | 258.03 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 41.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 258.03265 |
| Heavy Atoms | 16 |
| Complexity | 244.0 |
Chemical Identifiers
| CAS Number | 7696-87-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(=O)NN=C(CCl)CCl |
| InChIKey | QTIGQSGVHBIPHT-UHFFFAOYSA-N |
Product Overview
Acetic acid, phenyl-, (2-chloro-1-(chloromethyl)ethylidene)hydrazide (CAS 7696-87-9), with molecular formula C11H12Cl2N2O and molecular weight 258.03 g/mol. IUPAC: N-(1,3-dichloropropan-2-ylideneamino)-2-phenylacetamide.
Chemical Property Profile of Acetic acid, phenyl-, (2-chloro-1-(chloromethyl)ethylidene)hydrazide
Property Insights of Acetic acid, phenyl-, (2-chloro-1-(chloromethyl)ethylidene)hydrazide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, phenyl-, (2-chloro-1-(chloromethyl)ethylidene)hydrazide. With a topological polar surface area (TPSA) of 41.5 Ų, Acetic acid, phenyl-, (2-chloro-1-(chloromethyl)ethylidene)hydrazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, phenyl-, (2-chloro-1-(chloromethyl)ethylidene)hydrazide has 1 hydrogen bond donor(s) and 2 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, phenyl-, (2-chloro-1-(chloromethyl)ethylidene)hydrazide?
The CAS number of Acetic acid, phenyl-, (2-chloro-1-(chloromethyl)ethylidene)hydrazide is 7696-87-9.
What is the molecular formula of Acetic acid, phenyl-, (2-chloro-1-(chloromethyl)ethylidene)hydrazide?
The molecular formula of Acetic acid, phenyl-, (2-chloro-1-(chloromethyl)ethylidene)hydrazide is C11H12Cl2N2O.
What is the molecular weight of Acetic acid, phenyl-, (2-chloro-1-(chloromethyl)ethylidene)hydrazide?
The molecular weight of Acetic acid, phenyl-, (2-chloro-1-(chloromethyl)ethylidene)hydrazide is 258.03 g/mol.
Where can I buy Acetic acid, phenyl-, (2-chloro-1-(chloromethyl)ethylidene)hydrazide?
You can request a quote for Acetic acid, phenyl-, (2-chloro-1-(chloromethyl)ethylidene)hydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, phenyl-, (2-chloro-1-(chloromethyl)ethylidene)hydrazide?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, phenyl-, (2-chloro-1-(chloromethyl)ethylidene)hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.