RefChem:1064096
TL;DR: RefChem:1064096 (CAS 101931-63-9) is a chemical compound with molecular formula C12H10Cl2F4N4O5 and molecular weight 436.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4Z)-1-chloro-2-[chloro(difluoro)methyl]-4-[(2,4-dinitrophenyl)hydrazinylidene]-1,1-difluoropentan-2-ol
Also Known As: 2-Pentanone, 5-chloro-4-chlorodifluoromethyl-5,5-difluoro-4-hydroxy-, (2,4-dinitrophenyl)hydrazone, (4Z)-1-chloro-2-[chloro(difluoro)methyl]-4-[(2,4-dinitrophenyl)hydrazinylidene]-1,1-difluoropentan-2-ol, RefChem:1064096
| Molecular Formula | C12H10Cl2F4N4O5 |
|---|---|
| Molecular Weight | 436.00 g/mol |
| LogP | 4.0752 |
| Topological Polar Surface Area | 130.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 435.99643 |
| Heavy Atoms | 27 |
| Complexity | 768.0351 |
Chemical Identifiers
| CAS Number | 101931-63-9 |
|---|---|
| SMILES | C/C(=N/NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/CC(C(F)(F)Cl)(C(F)(F)Cl)O |
Product Overview
RefChem:1064096 (CAS 101931-63-9), with molecular formula C12H10Cl2F4N4O5 and molecular weight 436.00 g/mol. IUPAC: (4Z)-1-chloro-2-[chloro(difluoro)methyl]-4-[(2,4-dinitrophenyl)hydrazinylidene]-1,1-difluoropentan-2-ol.
Chemical Property Profile of RefChem:1064096
Property Insights of RefChem:1064096
The XLogP value of 4.0752 indicates that RefChem:1064096 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.9 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1064096. Following Lipinski's Rule of Five, RefChem:1064096 has 2 hydrogen bond donor(s) and 7 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 RefChem:1064096?
The CAS number of RefChem:1064096 is 101931-63-9.
What is the molecular formula of RefChem:1064096?
The molecular formula of RefChem:1064096 is C12H10Cl2F4N4O5.
What is the molecular weight of RefChem:1064096?
The molecular weight of RefChem:1064096 is 436.00 g/mol.
Where can I buy RefChem:1064096?
You can request a quote for RefChem:1064096 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1064096?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1064096 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.