5-Methyl-2,3-dihydro-1,3,4-oxadiazol-2-one
TL;DR: 5-Methyl-2,3-dihydro-1,3,4-oxadiazol-2-one (CAS 3069-67-8) is a chemical compound with molecular formula C3H4N2O2 and molecular weight 100.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-3H-1,3,4-oxadiazol-2-one
Also Known As: 5-Methyl-1,3,4-oxadiazol-2(3H)-one, 5-methyl-1,3,4-oxadiazol-2-ol, 5-methyl-3H-1,3,4-oxadiazol-2-one, 5-methyl-1,3,4-oxadiazol-2(3H)one, 1,3,4-oxadiazol-2-ol, 5-methyl-
| Molecular Formula | C3H4N2O2 |
|---|---|
| Molecular Weight | 100.03 g/mol |
| LogP | -0.32868 |
| Topological Polar Surface Area | 58.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 100.027275 |
| Heavy Atoms | 7 |
| Complexity | 198.69986 |
Chemical Identifiers
| CAS Number | 3069-67-8 |
|---|---|
| SMILES | CC1=NNC(=O)O1 |
Product Overview
5-Methyl-2,3-dihydro-1,3,4-oxadiazol-2-one (CAS 3069-67-8), with molecular formula C3H4N2O2 and molecular weight 100.03 g/mol. IUPAC: 5-methyl-3H-1,3,4-oxadiazol-2-one.
Chemical Property Profile of 5-Methyl-2,3-dihydro-1,3,4-oxadiazol-2-one
Property Insights of 5-Methyl-2,3-dihydro-1,3,4-oxadiazol-2-one
The XLogP value of -0.32868 indicates that 5-Methyl-2,3-dihydro-1,3,4-oxadiazol-2-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 58.89 Ų, 5-Methyl-2,3-dihydro-1,3,4-oxadiazol-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methyl-2,3-dihydro-1,3,4-oxadiazol-2-one has 1 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 5-Methyl-2,3-dihydro-1,3,4-oxadiazol-2-one?
The CAS number of 5-Methyl-2,3-dihydro-1,3,4-oxadiazol-2-one is 3069-67-8.
What is the molecular formula of 5-Methyl-2,3-dihydro-1,3,4-oxadiazol-2-one?
The molecular formula of 5-Methyl-2,3-dihydro-1,3,4-oxadiazol-2-one is C3H4N2O2.
What is the molecular weight of 5-Methyl-2,3-dihydro-1,3,4-oxadiazol-2-one?
The molecular weight of 5-Methyl-2,3-dihydro-1,3,4-oxadiazol-2-one is 100.03 g/mol.
Where can I buy 5-Methyl-2,3-dihydro-1,3,4-oxadiazol-2-one?
You can request a quote for 5-Methyl-2,3-dihydro-1,3,4-oxadiazol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-2,3-dihydro-1,3,4-oxadiazol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-2,3-dihydro-1,3,4-oxadiazol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.