1-(1H-Indazol-6-yl)ethanone supplier

Name
Ethanone, 1-(1H-indazol-6-yl)- (9CI)
EINECS
CAS No. 189559-85-1
Article Data3
CAS DataBase
Density 1.264 g/cm³
Solubility
Melting Point
Formula C₉H₈N₂O
Boiling Point 348.8 °C at 760 mmHg
Molecular Weight 160.175
Flash Point 168.8 °C
Transport Information
Appearance colorless transparent liquid or white solid
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-(1H-Indazol-6-yl)ethanone;
PSA 45.75000
LogP 1.76550

1-(1H-Indazol-6-yl)ethanone Specification

The cas register number of 1-(1H-Indazol-6-yl)ethanone is 189559-85-1. It also can be called as Ethanone,1-(1H-indazol-6-yl)- and the Systematic name about this chemical is 1-(1H-indazol-6-yl)ethanone. It belongs to the Acetylgroup.

Physical properties about 1-(1H-Indazol-6-yl)ethanone are: (1)ACD/LogP: 1.27; (2)ACD/LogD (pH 5.5): 1.27; (3)ACD/LogD (pH 7.4): 1.27; (4)#H bond acceptors: 3; (5)#H bond donors: 1; (6)#Freely Rotating Bonds: 1; (7)Polar Surface Area: 45.75Å²; (8)Index of Refraction: 1.658; (9)Molar Refractivity: 46.64 cm³; (10)Molar Volume: 126.6 cm³; (11)Polarizability: 18.49x10^-24cm³; (12)Surface Tension: 58.3 dyne/cm; (13)Enthalpy of Vaporization: 59.33 kJ/mol; (14)Vapour Pressure: 4.9E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(=O)c1ccc2cn[nH]c2c1
(2)InChI: InChI=1/C9H8N2O/c1-6(12)7-2-3-8-5-10-11-9(8)4-7/h2-5H,1H3,(H,10,11)
(3)InChIKey: PCVRYEUFVDIBFI-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C9H8N2O/c1-6(12)7-2-3-8-5-10-11-9(8)4-7/h2-5H,1H3,(H,10,11)
(5)Std. InChIKey: PCVRYEUFVDIBFI-UHFFFAOYSA-N

Product Name

Ethanone, 1-(1H-indazol-6-yl)- (9CI)

1-(1H-Indazol-6-yl)ethanone Specification

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