chempirical

Nifuroxazide

C12H9N3O5CAS 965-52-6275.22 g/mol

Open in Covalent MOL file
ON+O−NNHOOHO
ImineNitroPhenol

Properties

Molecular formula
C12H9N3O5
Molar mass
275.22 g/mol
Exact mass
275.0542 Da
Melting point
298 °C
logP
2.23Crippen estimate
Polar surface area
121.5 Ų
H-bond donors / acceptors
2 / 6
Rotatable bonds
4

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
965-52-6
SMILES
O=[N+]([O-])c1ccc(C=NN=C(O)c2ccc(O)cc2)o1
InChIKey
YCWSUKQGVSGXJO-UHFFFAOYSA-N
InChI
InChI=1S/C12H9N3O5/c16-9-3-1-8(2-4-9)12(17)14-13-7-10-5-6-11(20-10)15(18)19/h1-7,16H,(H,14,17)

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Names and synonyms

21 names · show all
  • Benzoic acid, 4-hydroxy-, 2-[(5-nitro-2-furanyl)methylene]hydrazide
  • Benzoic acid, p-hydroxy-, (5-nitrofurfurylidene)hydrazide
  • Benzoic acid, 4-hydroxy-, [(5-nitro-2-furanyl)methylene]hydrazide
  • RC 30-109
  • 5-Nitro-2-furfurylidene-4-hydroxybenzhydrazide
  • (5-Nitro-2-furfurylidene)(4-hydroxybenzoyl)hydrazine
  • p-Hydroxybenzoic acid (5-nitrofurfurylidene)hydrazide
  • 1-(p-Hydroxybenzoyl)-2-(5-nitrofurfurylidene)hydrazine
  • 5-Nitro-2-furaldehyde p-hydroxybenzoylhydrazone
  • Diarlidan
  • Dicoferin
  • Nifuroxazid
  • Ercefurol
  • Ercefuryl
  • 27-109RC
  • Pentofuryl
  • Bacifurane
  • RC 27109
  • Adral
  • Enterofuril
  • Antinal

Work with Nifuroxazide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Nifursol16915-70-161 % similar Nitrofurazone59-87-053 % similar 3-(5-Nitro-2-furyl)acrylic acid6281-23-846 % similar Furantoin67-20-945 % similar 5-Nitrofurfural698-63-545 % similar Furazolidone67-45-842 % similar 3-(5-Nitro-2-furyl)acrolein1874-22-241 % similar Nifuratel4936-47-440 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Disperse yellow 1119-15-3

Elsewhere

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