11-Azido-3,6,9-trioxaundecanoic acid

C₈H₁₅N₃O₅CAS 172531-37-2233.22 g/mol

Open in Covalent MOL file

Azide Carboxylic acid Ether

Properties

Molecular formula: C₈H₁₅N₃O₅
Molar mass: 233.22 g/mol
Exact mass: 233.1012 Da
logP: 0.43Crippen estimate
Polar surface area: 113.8 Å²
H-bond donors / acceptors: 1 / 5
Rotatable bonds: 11

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

172531-37-2

SMILES

C(COCCOCCOCC(=O)O)N=[N+]=[N-]

InChIKey

GIXBCECBLAEYKA-UHFFFAOYSA-N

InChI

InChI=1S/C8H15N3O5/c9-11-10-1-2-14-3-4-15-5-6-16-7-8(12)13/h1-7H2,(H,12,13)

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Work with 11-Azido-3,6,9-trioxaundecanoic acid

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

Poly(oxy-1,2-ethanediyl), α-(2-azidoethyl)-ω-(2-carboxyethoxy)-1167575-20-376 % similar 15-Azido-4,7,10,13-tetraoxapentadecanoic acid1257063-35-676 % similar 3-[2-(2-Azidoethoxy)ethoxy]propanoic acid1312309-63-976 % similar 3,6,9-Trioxaundecanedioic acid13887-98-460 % similar 2,2′-[1,2-Ethanediylbis(oxy)]bis[acetic acid]23243-68-757 % similar Polyethylene glycol bis(carboxymethyl) ether39927-08-757 % similar 2-(2-(2-Azidoethoxy)ethoxy)ethanol86520-52-754 % similar 1-Azido-3,6,9-trioxaundecane-11-ol86770-67-454 % similar

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

Elsewhere

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