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622-79-7

622-79-7 Structure

622-79-7 Structure
IdentificationMore
[Name]

BENZYL AZIDE
[CAS]

622-79-7
[Synonyms]

(AZIDOMETHYL)BENZENE
BENZYL AZIDE
TIMTEC-BB SBB008183
(azidomethyl)-benzen
alpha-azido-toluen
alpha-Azidotoluene
Benzene,azidomethyl-
Toluene, alpha-azido-
Toluene, alpha-triazo-
Benzyl Azide, Pract.
Benzylazide,94%
triazotoluene
(Azidomethyl)benzene, Pract.
Benzylazide 98%
[Molecular Formula]

C7H7N3
[MDL Number]

MFCD00013836
[Molecular Weight]

133.15
[MOL File]

622-79-7.mol
Chemical PropertiesBack Directory
[Melting point ]

157℃
[Boiling point ]

81-83°C 16mm
[density ]

1.0655
[refractive index ]

1.5341
[RTECS ]

XS6650000
[Fp ]

82-85°C/16mm
[storage temp. ]

2-8°C
[form ]

Liquid
[Specific Gravity]

1.0655
[Water Solubility ]

Insoluble in waterMiscible with ethanol and diethyl ether. Immiscible with water.
[BRN ]

636825
[CAS DataBase Reference]

622-79-7(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R2:Risk of explosion by shock, friction, fire or other sources of ignition.
R11:Highly Flammable.
[Safety Statements ]

S15:Keep away from heat .
S17:Keep away from combustible material .
S33:Take precautionary measures against static discharges .
[RIDADR ]

1993
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HazardClass ]

3
[PackingGroup ]

III
[HS Code ]

29299090
Hazard InformationBack Directory
[Uses]

Benzyl azide is used in the synthesis of 1,2,3-triazole derivatives. It serves as a reagent used to introduce a PhCH2N group into a molecule.
[Uses]

BENZYL AZIDE was used in the synthesis of stable 1,2,3-triazole derivatives.
[Synthesis Reference(s)]

Tetrahedron Letters, 16, p. 471, 1975 DOI: 10.1016/S0040-4039(00)71896-X
Journal of the American Chemical Society, 91, p. 4323, 1969 DOI: 10.1021/ja01043a071
[General Description]

Benzyl azide is an aromatic azide generally used in copper(I)-catalyzed azide-alkyne cycloaddition reactions.
[Safety Profile]

A heat-sensitive explosive.Explosive reaction with bis(trifluoromethyl)nitroxide.Upon decomposition it emits toxic fumes of NOx. Seealso AZIDES.
[Synthesis]

Sodium azide (3.58 g, 55.0 mmol) was added to DMSO (120 mL) and stirred vigorously until fully dissolved. Benzyl bromide 168 (6.54 mL, 55 mmol) was added. The reaction mixture was stirred at RT overnight. The colourless liquid was worked up with water (100 mL), and extracted with diethyl ether (3 x 100 mL). The extractions were washed with water (2 x 80 mL) and brine (80 mL). The ether layer was dried over MgSO4 and after filtration, it was evaporated to dryness, giving benzyl azide 73 as a colourless oil (6.9 g, 51.8 mmol, 94%): IR (neat) νm a x / cm– 1 3455, 3028, 2970, 2946, 2093, 1605, 1586, 1496, 1454, 1349, 1252; 1H NMR (400 MHz, CDCl 3 ) δ 7.44 – 7.28 (m, 5H), 4.33 (s, 2H); 1 3C NMR (100 MHz, CDCl 3 ) δ 135.55, 129.05, 128.52, 128.44, 55.00.
benzyl azide.jpg
Spectrum DetailBack Directory
[Spectrum Detail]

BENZYL AZIDE(622-79-7)1HNMR
BENZYL AZIDE(622-79-7)13CNMR
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

Benzyl azide, 94%(622-79-7)
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