chempirical

Azidobenzene

C6H5N3CAS 622-37-7119.13 g/mol

Open in Covalent MOL file
NN+N−
Azide

Properties

Molecular formula
C6H5N3
Molar mass
119.13 g/mol
Exact mass
119.0483 Da
logP
2.63Crippen estimate
Polar surface area
48.8 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Identifiers

CAS number
622-37-7
SMILES
C1=CC=C(C=C1)N=[N+]=[N-]
InChIKey
CTRLRINCMYICJO-UHFFFAOYSA-N
InChI
InChI=1S/C6H5N3/c7-9-8-6-4-2-1-3-5-6/h1-5H

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Names and synonyms

5 names
  • Phenyl azide
  • Phenylazide
  • Benzene, triazo-
  • Benzene, azido-
  • Azido-benzene

Work with Azidobenzene

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

4-Azidobenzoic acid6427-66-345 % similar Benzyl azide622-79-744 % similar Azobenzene103-33-343 % similar P-Azido-L-phenylalanine33173-53-435 % similar Formanilide103-70-833 % similar Phenyl isocyanate103-71-933 % similar Phenyl isothiocyanate103-72-033 % similar N-Sulfinylbenzenamine1122-83-433 % similar

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

Same formula

1H-Pyrazolo[3,4-C]pyridine271-47-6 Imidazo[4,5-B]pyridine273-21-2 Pyrazolopyrimidine274-71-5 Imidazo[1,2-A]pyrazine274-79-3 2-Amino-5-cyanopyridine4214-73-7 Benzotriazole95-14-7

Elsewhere

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