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622-37-7

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622-37-7 Structure

622-37-7 Structure

Identification	Back Directory
[Name] PHENYL AZIDE
[CAS] 622-37-7
[Synonyms] Azidobenzene PHENYL AZIDE triazobenzene Azido-benzene phenylazoimide Benzene, triazo- diazobenzeneimide Azidobenzene solution Phenyl azide solution Azidomethane solution - 0.5M solution intert-butyl methyl ether Azidobenzene solution ~0.5 M in tert-butyl Methyl ether, >=95.0% Azidobenzene solution ~0.5 M in 2-methyltetrahydrofuran, >=95.0% (HPLC)
[EINECS(EC#)] 210-730-3
[Molecular Formula] C6H5N3
[MDL Number] MFCD00040895
[MOL File] 622-37-7.mol
[Molecular Weight] 119.12

Chemical Properties	Back Directory
[Melting point ] -27.5°C
[Boiling point ] 212.39°C (rough estimate)
[density ] 1.0860
[vapor density ] 73.5 at 22-24 mm
[refractive index ] 1.5589
[Fp ] -12°C
[storage temp. ] -20°C
[form ] liquid
[color ] Pale-yellow oil
[BRN ] 742248
[InChI] InChI=1S/C6H5N3/c7-9-8-6-4-2-1-3-5-6/h1-5H
[InChIKey] CTRLRINCMYICJO-UHFFFAOYSA-N
[SMILES] C1(N=[N+]=[N-])=CC=CC=C1

Safety Data	Back Directory
[Symbol(GHS) ] GHS02,GHS05,GHS07,GHS08
[Signal word ] Danger
[Hazard statements ] H225-H302-H315-H318-H373
[Precautionary statements ] P210-P280-P301+P312-P303+P361+P353-P305+P351+P338-P314
[Hazard Codes ] F,Xn
[Risk Statements ] 11-19-48/20/21/22-38
[Safety Statements ] 16
[RIDADR ] UN 2398 3 / PGII
[WGK Germany ] 3
[Storage Class] 3 - Flammable liquids
[Hazard Classifications] Acute Tox. 4 Oral Eye Dam. 1 Flam. Liq. 2 Skin Irrit. 2 STOT RE 2

Hazard Information	Back Directory
[Uses] Phenylazide in greener solvent, 2-methyltetrahydrofuran (2-MeTHF). 2-Methyltetrahydrofuran (2-MeTHF): A Biomass-Derived Solvent with Broad Application in Organic Chemistry
[Synthesis Reference(s)] Journal of the American Chemical Society, 89, p. 5284, 1967 DOI: 10.1021/ja00996a036 Tetrahedron Letters, 27, p. 4749, 1986 DOI: 10.1016/S0040-4039(00)85055-8
[General Description] Azidobenzene solution can undergo click reaction with alkyne-functionalized oligomers to form O-ester-functionalized o-phenylenes, a group of aromatic foldamers with a good folding tendency in most solvents.
[Safety Profile] Explodes when heated.Explosive or violent reactions with Lewis acids [e.g., aluminum chloride (explosive); sulfuric acid (violent)]. When heated to decomposition it emits toxic fumes of NOx.

Spectrum Detail	Back Directory
[Spectrum Detail] PHENYL AZIDE(622-37-7)MS PHENYL AZIDE(622-37-7)¹HNMR PHENYL AZIDE(622-37-7)¹³CNMR

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