Einecs 262-178-8
TL;DR: Einecs 262-178-8 (CAS 60329-36-4) is a chemical compound with molecular formula C13H16ClN3O and molecular weight 265.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-3-phenyl-1H-pyridazin-4-one;propan-1-amine
Also Known As: EINECS 262-178-8, 6-Chloro-3-phenylpyridazin-4-ol, compound with propylamine (1:1), 6-chloro-3-phenyl-1H-pyridazin-4-one,propan-1-amine, 6-chloro-3-phenyl-1H-pyridazin-4-one; propan-1-amine, 6-Chloro-3-phenylpyridazin-4(1H)-one--propan-1-amine (1/1)
| Molecular Formula | C13H16ClN3O |
|---|---|
| Molecular Weight | 265.10 g/mol |
| LogP | 2.4454 |
| Topological Polar Surface Area | 71.77 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 265.09818 |
| Heavy Atoms | 18 |
| Complexity | 523.2596 |
Chemical Identifiers
| CAS Number | 60329-36-4 |
|---|---|
| SMILES | CCCN.C1=CC=C(C=C1)C2=NNC(=CC2=O)Cl |
Product Overview
Einecs 262-178-8 (CAS 60329-36-4), with molecular formula C13H16ClN3O and molecular weight 265.10 g/mol. IUPAC: 6-chloro-3-phenyl-1H-pyridazin-4-one;propan-1-amine.
Chemical Property Profile of Einecs 262-178-8
Property Insights of Einecs 262-178-8
The XLogP value of 2.4454 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Einecs 262-178-8. The TPSA of 71.77 Ų falls within the moderate polarity range, balancing permeability and solubility for Einecs 262-178-8. Following Lipinski's Rule of Five, Einecs 262-178-8 has 2 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 Einecs 262-178-8?
The CAS number of Einecs 262-178-8 is 60329-36-4.
What is the molecular formula of Einecs 262-178-8?
The molecular formula of Einecs 262-178-8 is C13H16ClN3O.
What is the molecular weight of Einecs 262-178-8?
The molecular weight of Einecs 262-178-8 is 265.10 g/mol.
Where can I buy Einecs 262-178-8?
You can request a quote for Einecs 262-178-8 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 262-178-8?
Yes, KEHONG BIO provides custom synthesis services for Einecs 262-178-8 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.