ChemicalBook--->CAS DataBase List--->72773-04-7

72773-04-7

72773-04-7 Structure

72773-04-7 Structure
IdentificationBack Directory
[Name]

1H-BENZOTRIAZOLE-1-CARBOXALDEHYDE
[CAS]

72773-04-7
[Synonyms]

1-Formyl-1H-benzotriazole
1H-benzotriazole-1-carbaldehyde
1H-BENZOTRIAZOLE-1-CARBOXALDEHYDE
1H-Benzotriazole-1-carboxyaldehyde
1H-Benzotriazole-1-carboxaldehyde>
1H-benzo[d][1,2,3]triazole-1-carbaldehyde
REF DUPL: 1H-benzotriazole-1-carbaldehyde
1H-Benzotriazole-1-carboxaldehyde (7CI, 9CI)
[Molecular Formula]

C7H5N3O
[MDL Number]

MFCD00239420
[MOL File]

72773-04-7.mol
[Molecular Weight]

147.13
Chemical PropertiesBack Directory
[Melting point ]

90-95 °C(lit.)
[Boiling point ]

314.8±25.0 °C(Predicted)
[density ]

1.39±0.1 g/cm3(Predicted)
[storage temp. ]

under inert gas (nitrogen or Argon) at 2-8°C
[form ]

powder to crystal
[pka]

-0.45±0.30(Predicted)
[color ]

White to Almost white
[InChI]

InChI=1S/C7H5N3O/c11-5-10-7-4-2-1-3-6(7)8-9-10/h1-5H
[InChIKey]

DVEIDGKSJOJJJU-UHFFFAOYSA-N
[SMILES]

N1(C=O)C2=CC=CC=C2N=N1
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36
[WGK Germany ]

3
[HS Code ]

2933998090
Spectrum DetailBack Directory
[Spectrum Detail]

1H-BENZOTRIAZOLE-1-CARBOXALDEHYDE(72773-04-7)1HNMR
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