6-Chloro-1H-indazole-3-carboxylicacid supplier

Name
6-CHLORO-1H-INDAZOLE-3-CARBOXYLIC ACID
EINECS
CAS No. 129295-31-4
Density 1.644g/cm³
Solubility
Melting Point
Formula C₈H₅ClN₂O₂
Boiling Point 472.131 °C at 760 mmHg
Molecular Weight 196.593
Flash Point 239.336 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 6-Chloro-1H-indazole-3-carboxylicacid;6-Chloroindazole-3-carboxylic acid;
PSA 65.98000
LogP 1.91450

6-Chloro-1H-indazole-3-carboxylicacid Specification

The 6-Chloro-1H-indazole-3-carboxylicacid, with CAS registry number 129295-31-4, has the systematic name of 6-chloro-1H-indazole-3-carboxylic acid. Besides this, it is also called 6-Chloroindazole-3-carboxylic acid. And the chemical formula of this chemical is C₈H₅ClN₂O₂.

Physical properties of 6-Chloro-1H-indazole-3-carboxylicacid: (1)ACD/LogP: 2.65; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): -1; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 3; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 65.98 Å²; (13)Index of Refraction: 1.744; (14)Molar Refractivity: 48.445 cm³; (15)Molar Volume: 119.576 cm³; (16)Polarizability: 19.205×10^-24cm³; (17)Surface Tension: 84.794 dyne/cm; (18)Density: 1.644 g/cm³; (19)Flash Point: 239.336 °C; (20)Enthalpy of Vaporization: 77.432 kJ/mol; (21)Boiling Point: 472.131 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc2c(c1)nnc2C(=O)O
(2)InChI: InChI=1/C8H5ClN2O2/c9-4-1-2-5-6(3-4)10-11-7(5)8(12)13/h1-3H,(H,10,11)(H,12,13)
(3)InChIKey: MCGHMISXTKQRRF-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C8H5ClN2O2/c9-4-1-2-5-6(3-4)10-11-7(5)8(12)13/h1-3H,(H,10,11)(H,12,13)
(5)Std. InChIKey: MCGHMISXTKQRRF-UHFFFAOYSA-N

Product Name

6-CHLORO-1H-INDAZOLE-3-CARBOXYLIC ACID

6-Chloro-1H-indazole-3-carboxylicacid Specification

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