4-((Hydroxyimino)methyl)imidazole-1,3-diol
TL;DR: 4-((Hydroxyimino)methyl)imidazole-1,3-diol (CAS 385377-31-1) is a chemical compound with molecular formula C4H5N3O3 and molecular weight 143.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(NE)-N-[(1-hydroxy-3-oxidoimidazol-3-ium-4-yl)methylidene]hydroxylamine
Also Known As: 4-((hydroxyimino)methyl)imidazole-1,3-diol, AB01334651-02, 1H-Imidazole-4-carboxaldehyde,1-hydroxy-,oxime,3-oxide, 4-[(E)-(hydroxyimino)methyl]-1H-imidazol-1-ol 3-oxide, (E)-1-hydroxy-4-((hydroxyimino)methyl)-1H-imidazole 3-oxide
| Molecular Formula | C4H5N3O3 |
|---|---|
| Molecular Weight | 143.03 g/mol |
| LogP | -0.8331 |
| Topological Polar Surface Area | 84.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 143.0331 |
| Heavy Atoms | 10 |
| Complexity | 254.25053 |
Chemical Identifiers
| CAS Number | 385377-31-1 |
|---|---|
| SMILES | C1=C([N+](=CN1O)[O-])/C=N/O |
Product Overview
4-((Hydroxyimino)methyl)imidazole-1,3-diol (CAS 385377-31-1), with molecular formula C4H5N3O3 and molecular weight 143.03 g/mol. IUPAC: (NE)-N-[(1-hydroxy-3-oxidoimidazol-3-ium-4-yl)methylidene]hydroxylamine.
Chemical Property Profile of 4-((Hydroxyimino)methyl)imidazole-1,3-diol
Property Insights of 4-((Hydroxyimino)methyl)imidazole-1,3-diol
The XLogP value of -0.8331 indicates that 4-((Hydroxyimino)methyl)imidazole-1,3-diol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 84.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((Hydroxyimino)methyl)imidazole-1,3-diol. Following Lipinski's Rule of Five, 4-((Hydroxyimino)methyl)imidazole-1,3-diol has 2 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 4-((Hydroxyimino)methyl)imidazole-1,3-diol?
The CAS number of 4-((Hydroxyimino)methyl)imidazole-1,3-diol is 385377-31-1.
What is the molecular formula of 4-((Hydroxyimino)methyl)imidazole-1,3-diol?
The molecular formula of 4-((Hydroxyimino)methyl)imidazole-1,3-diol is C4H5N3O3.
What is the molecular weight of 4-((Hydroxyimino)methyl)imidazole-1,3-diol?
The molecular weight of 4-((Hydroxyimino)methyl)imidazole-1,3-diol is 143.03 g/mol.
Where can I buy 4-((Hydroxyimino)methyl)imidazole-1,3-diol?
You can request a quote for 4-((Hydroxyimino)methyl)imidazole-1,3-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((Hydroxyimino)methyl)imidazole-1,3-diol?
Yes, KEHONG BIO provides custom synthesis services for 4-((Hydroxyimino)methyl)imidazole-1,3-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.