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107469-72-7

107469-72-7 Structure

107469-72-7 Structure
IdentificationBack Directory
[Name]

5-benzyl-4H-1,2,4-triazole-3-carboxylic acid
[CAS]

107469-72-7
[Synonyms]

5-benzyl-4H-1,2,4-triazole-3-carboxylic acid
3-Benzyl-1H-1,2,4-triazole-5-carboxylic acid
5-benzyl-1H-1,2,4-triazole-3-carboxylic acid
3-(Phenylmethyl)-1H-1,2,4-triazole-5-carboxylic acid
Product Name:5-benzyl-4H-1,2,4-triazole-3-carboxylic acid
5-benzyl-4H-1,2,4-triazole-3-carboxylic acid hydrochloride
[Molecular Formula]

C10H9N3O2
[MDL Number]

MFCD32690791
[MOL File]

107469-72-7.mol
[Molecular Weight]

203.2
Chemical PropertiesBack Directory
[Boiling point ]

499.7±38.0 °C(Predicted)
[density ]

1.390±0.06 g/cm3(Predicted)
[pka]

11.26±0.40(Predicted)
[InChI]

InChI=1S/C10H9N3O2/c14-10(15)9-11-8(12-13-9)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,14,15)(H,11,12,13)
[InChIKey]

WTZOKLZJHWSCBN-UHFFFAOYSA-N
[SMILES]

N1C(C(O)=O)=NC(CC2=CC=CC=C2)=N1
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319
[Precautionary statements ]

P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Spectrum DetailBack Directory
[Spectrum Detail]

5-benzyl-4H-1,2,4-triazole-3-carboxylic acid(107469-72-7)1HNMR
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