1-Hydroxy-2,2,5,5-tetramethyl-4-imidazolidinecarbonitrile 3-oxide
TL;DR: 1-Hydroxy-2,2,5,5-tetramethyl-4-imidazolidinecarbonitrile 3-oxide (CAS 65383-92-8) is a chemical compound with molecular formula C8H13N3O2 and molecular weight 183.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hydroxy-2,2,5,5-tetramethyl-3-oxidoimidazol-3-ium-4-carbonitrile
Also Known As: NCI60_021959, 1-Hydroxy-2,2,5,5-tetramethyl-2,5-dihydro-1H-imidazole-4-carbonitrile 3-oxide, 1-hydroxy-2,2,5,5-tetramethyl-3-oxidoimidazol-3-ium-4-carbonitrile, 1-Hydroxy-2,2,5,5-tetramethyl-4-imidazolidinecarbonitrile 3-oxide, 1-hydroxy-2,2,5,5-tetramethyl-3-oxido-imidazol-3-ium-4-carbonitrile
| Molecular Formula | C8H13N3O2 |
|---|---|
| Molecular Weight | 183.10 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 183.10077 |
| Heavy Atoms | 13 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 65383-92-8 |
|---|---|
| SMILES | CC1(C(=[N+](C(N1O)(C)C)[O-])C#N)C |
| InChIKey | ASTJTQSJRMMCCR-UHFFFAOYSA-N |
Product Overview
1-Hydroxy-2,2,5,5-tetramethyl-4-imidazolidinecarbonitrile 3-oxide (CAS 65383-92-8), with molecular formula C8H13N3O2 and molecular weight 183.10 g/mol. IUPAC: 1-hydroxy-2,2,5,5-tetramethyl-3-oxidoimidazol-3-ium-4-carbonitrile.
Chemical Property Profile of 1-Hydroxy-2,2,5,5-tetramethyl-4-imidazolidinecarbonitrile 3-oxide
Property Insights of 1-Hydroxy-2,2,5,5-tetramethyl-4-imidazolidinecarbonitrile 3-oxide
The XLogP value of -0.2 indicates that 1-Hydroxy-2,2,5,5-tetramethyl-4-imidazolidinecarbonitrile 3-oxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Hydroxy-2,2,5,5-tetramethyl-4-imidazolidinecarbonitrile 3-oxide. Following Lipinski's Rule of Five, 1-Hydroxy-2,2,5,5-tetramethyl-4-imidazolidinecarbonitrile 3-oxide 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 1-Hydroxy-2,2,5,5-tetramethyl-4-imidazolidinecarbonitrile 3-oxide?
The CAS number of 1-Hydroxy-2,2,5,5-tetramethyl-4-imidazolidinecarbonitrile 3-oxide is 65383-92-8.
What is the molecular formula of 1-Hydroxy-2,2,5,5-tetramethyl-4-imidazolidinecarbonitrile 3-oxide?
The molecular formula of 1-Hydroxy-2,2,5,5-tetramethyl-4-imidazolidinecarbonitrile 3-oxide is C8H13N3O2.
What is the molecular weight of 1-Hydroxy-2,2,5,5-tetramethyl-4-imidazolidinecarbonitrile 3-oxide?
The molecular weight of 1-Hydroxy-2,2,5,5-tetramethyl-4-imidazolidinecarbonitrile 3-oxide is 183.10 g/mol.
Where can I buy 1-Hydroxy-2,2,5,5-tetramethyl-4-imidazolidinecarbonitrile 3-oxide?
You can request a quote for 1-Hydroxy-2,2,5,5-tetramethyl-4-imidazolidinecarbonitrile 3-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Hydroxy-2,2,5,5-tetramethyl-4-imidazolidinecarbonitrile 3-oxide?
Yes, KEHONG BIO provides custom synthesis services for 1-Hydroxy-2,2,5,5-tetramethyl-4-imidazolidinecarbonitrile 3-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.