Basic information
- Name:
1H-Indazol-6-ol,3-methyl-
- Superlist Name:
- 6-Hydroxy-3-methylindazole
- CAS No.:
201286-99-9
- Molecular Structure:
- Formula:
- C8H8N2O
- Molecular Weight:
- 148.16
- Synonyms:
- 6-Hydroxy-3-methylindazole;
- Density:
- 1.349 g/cm3
- Boiling Point:
- 366.002 °C at 760 mmHg
- Flash Point:
- 175.152 °C
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Specification
The 6-Hydroxy-3-methylindazole with the cas number 201286-99-9 is also called 1H-Indazol-6-ol,3-methyl-. The systematic name is 3-methyl-1H-indazol-6-ol. Its molecular formula is C8H8N2O. This chemical is a kind of organics. It should be stored in dry and cool environment.
The properties of the chemical are: (1)ACD/LogP: 1.15; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 9; (6)ACD/BCF (pH 7.4): 9; (7)ACD/KOC (pH 5.5): 164; (8)ACD/KOC (pH 7.4): 163; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 48.91Å2; (13)Index of Refraction: 1.719; (14)Molar Refractivity: 43.326 cm3; (15)Molar Volume: 109.8 cm3; (16)Polarizability: 17.176×10-24cm3; (17)Surface Tension: 69.928 dyne/cm; (18)Enthalpy of Vaporization: 63.645 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Oc1ccc2c(c1)nnc2C
(2)InChI: InChI=1/C8H8N2O/c1-5-7-3-2-6(11)4-8(7)10-9-5/h2-4,11H,1H3,(H,9,10)
(3)InChIKey: WTNPPQUZRFSUQF-UHFFFAOYAV
