RefChem:91961
TL;DR: RefChem:91961 (CAS 99573-84-9) is a chemical compound with molecular formula C11H19N3O2 and molecular weight 225.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[1-(2-aminoethyl)-4,5-dihydroimidazol-2-yl]methyl]oxan-2-one
Also Known As: 3-((1-(2-Aminoethyl)-4,5-dihydro-1H-imidazol-2-yl)methyl)tetrahydro-2H-pyran-2-one, 3-[[1-(2-AMINOETHYL)-4,5-DIHYDRO-1H-IMIDAZOL-2-YL]METHYL]TETRAHYDRO-2H-PYRAN-2-ONE, 3-[[1-(2-aminoethyl)-4,5-dihydroimidazol-2-yl]methyl]oxan-2-one, 3-{[1-(2-Aminoethyl)-4,5-dihydro-1H-imidazol-2-yl]methyl}oxan-2-one, 3-[[1- -4,5-dihydro-1H-imidazol-2-yl]methyl]tetrahydro-2H-pyran-2-one
| Molecular Formula | C11H19N3O2 |
|---|---|
| Molecular Weight | 225.15 g/mol |
| LogP | -1.3 |
| Topological Polar Surface Area | 67.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 225.14772 |
| Heavy Atoms | 16 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 99573-84-9 |
|---|---|
| SMILES | C1CC(C(=O)OC1)CC2=NCCN2CCN |
| InChIKey | LKRSUEODZDWQAF-UHFFFAOYSA-N |
Product Overview
RefChem:91961 (CAS 99573-84-9), with molecular formula C11H19N3O2 and molecular weight 225.15 g/mol. IUPAC: 3-[[1-(2-aminoethyl)-4,5-dihydroimidazol-2-yl]methyl]oxan-2-one.
Chemical Property Profile of RefChem:91961
Property Insights of RefChem:91961
The XLogP value of -1.3 indicates that RefChem:91961 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 67.9 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:91961. Following Lipinski's Rule of Five, RefChem:91961 has 1 hydrogen bond donor(s) and 4 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:91961?
The CAS number of RefChem:91961 is 99573-84-9.
What is the molecular formula of RefChem:91961?
The molecular formula of RefChem:91961 is C11H19N3O2.
What is the molecular weight of RefChem:91961?
The molecular weight of RefChem:91961 is 225.15 g/mol.
Where can I buy RefChem:91961?
You can request a quote for RefChem:91961 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:91961?
Yes, KEHONG BIO provides custom synthesis services for RefChem:91961 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.