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Name | 3-(2H-Tetrazol-5-Yl)-Benzoic Acid |
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Synonyms | 3-(2H-1,2,3,4-Tetrazol-5-Yl)Benzoic Acid; A3277/0139431; 3-(2H-Tetrazol-5-Yl)-Benzoic Acid |
Molecular Structure | ![]() |
Molecular Formula | C8H6N4O2 |
Molecular Weight | 190.16 |
CAS Registry Number | 73096-39-6 |
SMILES | C2=C(C1=N[NH]N=N1)C=CC=C2C(O)=O |
InChI | 1S/C8H6N4O2/c13-8(14)6-3-1-2-5(4-6)7-9-11-12-10-7/h1-4H,(H,13,14)(H,9,10,11,12) |
InChIKey | MIERACSHCALJOM-UHFFFAOYSA-N |
Density | 1.5±0.1g/cm3 (Cal.) |
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Melting point | 284-286°C (Expl.) |
Boiling point | 496.4±47.0°C at 760 mmHg (Cal.) |
Flash point | 254.0±29.3°C (Cal.) |
Safety Code | S26;S37 Details |
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Risk Code | R36/37/38 Details |
Hazard Symbol | ![]() |
Safety Description | TOXIC |
WARNING: Irritates lungs, eyes, skin | |
SDS | Available |
(1) | Lin Cheng, Ya-Wen Zhang, Jian-Quan Wang and Gong Zhang . 3-(1H-Tetrazol-5-yl)benzoic acid , Acta Cryst (2009). E65, o89Â Â |
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Market Analysis Reports |
List of Reports Available for 3-(2H-Tetrazol-5-Yl)-Benzoic Acid |