ChemicalBook--->CAS DataBase List--->2101-86-2

2101-86-2

2101-86-2 Structure

2101-86-2 Structure
IdentificationBack Directory
[Name]

NISTC2101862
[CAS]

2101-86-2
[Synonyms]

NISTC2101862
4-Azidotoluene
4-Methylphenyl azide
p-Methylphenyl azide
4-Azidotoluene solution
4-Methyl-1-azidobenzene
1-Methyl-4-azidobenzene
4-Azidotoluene solution ~0.5 M in tert-butyl methyl ether, >=95.0% (HPLC)
[MDL Number]

MFCD09971470
[MOL File]

2101-86-2.mol
Chemical PropertiesBack Directory
[Melting point ]

-29°C
[Boiling point ]

235.67°C (rough estimate)
[density ]

1.0527
[refractive index ]

1.5341 (estimate)
[Fp ]

-33℃
[storage temp. ]

-20°C
[form ]

liquid
[BRN ]

1841411
[InChI]

1S/C7H7N3/c1-6-2-4-7(5-3-6)9-10-8/h2-5H,1H3
[InChIKey]

YVXDRCDGBCOJHX-UHFFFAOYSA-N
[SMILES]

Cc1ccc(cc1)N=[N+]=[N-]
Safety DataBack Directory
[Symbol(GHS) ]

Flame (GHS02)Exclamation Mark (GHS07)
GHS02,GHS07
[Signal word ]

Danger
[Hazard statements ]

H225-H315-H319
[Precautionary statements ]

P210-P305+P351+P338
[Hazard Codes ]

F,Xi
[Risk Statements ]

11-38
[Safety Statements ]

16
[RIDADR ]

UN 2398 3 / PGII
[WGK Germany ]

3
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Flam. Liq. 2
Skin Irrit. 2
Hazard InformationBack Directory
[Uses]

4-Azidotoluene solution may be used for the functionalization at the axial position of boron subphthalocyanines with a terminal acetylene functionality via copper(I)-catalyzed azide-alkyne cycloaddition in the presence of Hunig′s base.
[General Description]

4-Azidotoluene is an aromatic azide generally used in copper(I)-catalyzed azide-alkyne cycloaddition reactions.
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