2-Furanacetic acid, α-(methoxyimino)-, ammonium salt (1:1), (αz)-

C₇H₁₀N₂O₄CAS 97148-39-5186.17 g/mol

Open in Covalent MOL file

Carboxylic acid Oxime

Properties

Molecular formula: C₇H₁₀N₂O₄
Molar mass: 186.17 g/mol
Exact mass: 186.0641 Da
logP: 0.88Crippen estimate
Polar surface area: 107.0 Å²
H-bond donors / acceptors: 2 / 5
Rotatable bonds: 3

Identifiers

CAS number

97148-39-5

SMILES

CO/N=C(C(=O)O)c1ccco1.N

InChIKey

ZWNSXPIVYODLLM-PHZXCRFESA-N

InChI

InChI=1S/C7H7NO4.H3N/c1-11-8-6(7(9)10)5-3-2-4-12-5;/h2-4H,1H3,(H,9,10);1H3/b8-6-;

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Names and synonyms

2 names

2-Furanacetic acid, α-(methoxyimino)-, ammonium salt, (Z)-
2-Furanacetic acid, α-(methoxyimino)-, ammonium salt, (αZ)-

Work with 2-Furanacetic acid, α-(methoxyimino)-, ammonium salt (1:1), (αz)-

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

Cefuroxime55268-75-244 % similar Methyl 2-furoate611-13-242 % similar α-Furil dioxime522-27-041 % similar 2-Furoic acid88-14-241 % similar (Αz)-2-amino-α-(methoxyimino)-4-thiazoleacetic acid65872-41-541 % similar (Αz)-2-(formylamino)-α-(methoxyimino)-4-thiazoleacetic acid65872-43-740 % similar 2-Acetylfuran1192-62-738 % similar (Αz)-5-amino-α-(methoxyimino)-1,2,4-thiadiazole-3-acetic acid72217-12-038 % similar

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

Same formula

Di-β-aminopropionitrile fumarate2079-89-2 Ampa74341-63-2 S-Ampa83643-88-3

Elsewhere

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