2,4-Dihydro-2,4-bis(2-oxiranylmethyl)-3H-1,2,4-triazol-3-one
TL;DR: 2,4-Dihydro-2,4-bis(2-oxiranylmethyl)-3H-1,2,4-triazol-3-one (CAS 86548-94-9) is a chemical compound with molecular formula C8H11N3O3 and molecular weight 197.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-bis(oxiran-2-ylmethyl)-1,2,4-triazol-3-one
Also Known As: 2,4-Dihydro-2,4-bis(oxiranylmethyl)-3H-1,2,4-triazol-3-one, 2,4-bis(oxiran-2-ylmethyl)-1,2,4-triazol-3-one, 3H-1,2,4-Triazol-3-one, 2,4-dihydro-2,4-bis(oxiranylmethyl)-, 1,4-Diglycidyl-1H-1,2,4-triazol-5(4H)-one, 2,4-Dihydro-2,4-bis(2-oxiranylmethyl)-3H-1,2,4-triazol-3-one
| Molecular Formula | C8H11N3O3 |
|---|---|
| Molecular Weight | 197.08 g/mol |
| LogP | -1.1576 |
| Topological Polar Surface Area | 64.88 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 197.08005 |
| Heavy Atoms | 14 |
| Complexity | 354.2809 |
Chemical Identifiers
| CAS Number | 86548-94-9 |
|---|---|
| SMILES | C1C(O1)CN2C=NN(C2=O)CC3CO3 |
Product Overview
2,4-Dihydro-2,4-bis(2-oxiranylmethyl)-3H-1,2,4-triazol-3-one (CAS 86548-94-9), with molecular formula C8H11N3O3 and molecular weight 197.08 g/mol. IUPAC: 2,4-bis(oxiran-2-ylmethyl)-1,2,4-triazol-3-one.
Chemical Property Profile of 2,4-Dihydro-2,4-bis(2-oxiranylmethyl)-3H-1,2,4-triazol-3-one
Property Insights of 2,4-Dihydro-2,4-bis(2-oxiranylmethyl)-3H-1,2,4-triazol-3-one
The XLogP value of -1.1576 indicates that 2,4-Dihydro-2,4-bis(2-oxiranylmethyl)-3H-1,2,4-triazol-3-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 64.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Dihydro-2,4-bis(2-oxiranylmethyl)-3H-1,2,4-triazol-3-one. Following Lipinski's Rule of Five, 2,4-Dihydro-2,4-bis(2-oxiranylmethyl)-3H-1,2,4-triazol-3-one has 0 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 2,4-Dihydro-2,4-bis(2-oxiranylmethyl)-3H-1,2,4-triazol-3-one?
The CAS number of 2,4-Dihydro-2,4-bis(2-oxiranylmethyl)-3H-1,2,4-triazol-3-one is 86548-94-9.
What is the molecular formula of 2,4-Dihydro-2,4-bis(2-oxiranylmethyl)-3H-1,2,4-triazol-3-one?
The molecular formula of 2,4-Dihydro-2,4-bis(2-oxiranylmethyl)-3H-1,2,4-triazol-3-one is C8H11N3O3.
What is the molecular weight of 2,4-Dihydro-2,4-bis(2-oxiranylmethyl)-3H-1,2,4-triazol-3-one?
The molecular weight of 2,4-Dihydro-2,4-bis(2-oxiranylmethyl)-3H-1,2,4-triazol-3-one is 197.08 g/mol.
Where can I buy 2,4-Dihydro-2,4-bis(2-oxiranylmethyl)-3H-1,2,4-triazol-3-one?
You can request a quote for 2,4-Dihydro-2,4-bis(2-oxiranylmethyl)-3H-1,2,4-triazol-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dihydro-2,4-bis(2-oxiranylmethyl)-3H-1,2,4-triazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dihydro-2,4-bis(2-oxiranylmethyl)-3H-1,2,4-triazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.