RefChem:89211
TL;DR: RefChem:89211 (CAS 68412-47-5) is a chemical compound with molecular formula C13H28N4O2 and molecular weight 272.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(2-aminoethyl)ethane-1,2-diamine;N-(2-methyl-4-oxopentan-2-yl)prop-2-enamide
Also Known As: EINECS 270-191-5, Diethylenetriamine diacetoneacrylamide adduct, 2-Propenamide, N-(1,1-dimethyl-3-oxobutyl)-, reaction products with diethylenetriamine, 2-Propenamide, N-(1,1-dimethyl-3-oxobutyl)-, reaction products withdiethylenetriamine, N'-(2-aminoethyl)ethane-1,2-diamine; N-(2-methyl-4-oxopentan-2-yl)prop-2-enamide
| Molecular Formula | C13H28N4O2 |
|---|---|
| Molecular Weight | 272.22 g/mol |
| LogP | -0.4603 |
| Topological Polar Surface Area | 110.24 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 272.22122 |
| Heavy Atoms | 19 |
| Complexity | 273.81677 |
Chemical Identifiers
| CAS Number | 68412-47-5 |
|---|---|
| SMILES | CC(=O)CC(C)(C)NC(=O)C=C.C(CNCCN)N |
Product Overview
RefChem:89211 (CAS 68412-47-5), with molecular formula C13H28N4O2 and molecular weight 272.22 g/mol. IUPAC: N'-(2-aminoethyl)ethane-1,2-diamine;N-(2-methyl-4-oxopentan-2-yl)prop-2-enamide.
Chemical Property Profile of RefChem:89211
Property Insights of RefChem:89211
The XLogP value of -0.4603 indicates that RefChem:89211 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 110.24 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:89211. Following Lipinski's Rule of Five, RefChem:89211 has 4 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 RefChem:89211?
The CAS number of RefChem:89211 is 68412-47-5.
What is the molecular formula of RefChem:89211?
The molecular formula of RefChem:89211 is C13H28N4O2.
What is the molecular weight of RefChem:89211?
The molecular weight of RefChem:89211 is 272.22 g/mol.
Where can I buy RefChem:89211?
You can request a quote for RefChem:89211 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:89211?
Yes, KEHONG BIO provides custom synthesis services for RefChem:89211 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.