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| CAS No.: | 61700-61-6 |
|---|---|
| Name: | 5-Carboxyindazole hydrochloride |
| Article Data: | 18 |
| Molecular Structure: | |
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| Formula: | C8H6N2O2.HCl |
| Molecular Weight: | 162.148 |
| Synonyms: | 1H-Indazole-5-carboxylicacid; |
| Density: | 1.506±0.06 g/cm3(Predicted) |
| Melting Point: | >250℃ |
| Boiling Point: | 443.7±18.0 °C(Predicted) |
| PSA: | 65.98000 |
| LogP: | 2.06310 |
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Specification
The 5-Carboxyindazole hydrochloride, with CAS registry number 61700-61-6, belongs to the following product categories: (1)Heterocycles series; (2)Pharmacetical; (3)Building Blocks; (4)Indazole. It has the systematic name of indazol-1-ium-5-carboxylic acid chloride. And the chemical formula of this chemical is C8H6N2O2.HCl.
Physical properties of 5-Carboxyindazole hydrochloride: (1)#H bond acceptors: 4; (2)#H bond donors: 2; (3)#Freely Rotating Bonds: 1; (4)Polar Surface Area: 50.19 Å2.
You can still convert the following datas into molecular structure:
(1)SMILES: [Cl-].OC(=O)c1cc2cn[nH+]c2cc1
(2)InChI: InChI=1/C8H6N2O2.ClH/c11-8(12)5-1-2-7-6(3-5)4-9-10-7;/h1-4H,(H,9,10)(H,11,12);1H
(3)InChIKey: GWFPHPWZNDFVJJ-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C8H6N2O2.ClH/c11-8(12)5-1-2-7-6(3-5)4-9-10-7;/h1-4H,(H,9,10)(H,11,12);1H
(5)Std. InChIKey: GWFPHPWZNDFVJJ-UHFFFAOYSA-N