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CAS No.: | 90223-02-2 |
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Name: | 2-METHYL-2H-INDAZOL-7-YLAMINE |
Molecular Structure: | |
Formula: | C8H9N3 |
Molecular Weight: | 147.17716 |
Synonyms: | 2H-Indazole,7-amino-2-methyl- (7CI); |
Density: | 1.27g/cm3 |
Melting Point: | 73 °C |
Boiling Point: | 354.8 °C at 760 mmHg |
Flash Point: | 168.4 °C |
PSA: | 43.84000 |
LogP: | 1.73670 |
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The 2H-Indazol-7-amine,2-methyl-, with CAS registry number 90223-02-2, belongs to the following product categories: (1)Building Blocks; (2)Indazole. It has the systematic name of 2-methyl-2H-indazol-7-amine. And its IUPAC name is 2-methylindazol-7-amine. What's more, the chemical formula of this chemical is C8H9N3.
Physical properties of 2H-Indazol-7-amine,2-methyl-: (1)ACD/LogP: 0.53; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.53; (4)ACD/LogD (pH 7.4): 0.53; (5)ACD/BCF (pH 5.5): 1.48; (6)ACD/BCF (pH 7.4): 1.48; (7)ACD/KOC (pH 5.5): 46.06; (8)ACD/KOC (pH 7.4): 46.15; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 21.06 Å2; (13)Index of Refraction: 1.667; (14)Molar Refractivity: 43.05 cm3; (15)Molar Volume: 115.5 cm3; (16)Polarizability: 17.06×10-24cm3; (17)Surface Tension: 49.8 dyne/cm; (18)Enthalpy of Vaporization: 59.99 kJ/mol; (19)Vapour Pressure: 3.26E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: n2c1c(cccc1cn2C)N
(2)InChI: InChI=1/C8H9N3/c1-11-5-6-3-2-4-7(9)8(6)10-11/h2-5H,9H2,1H3
(3)InChIKey: KNZJAZZOKTUEHM-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C8H9N3/c1-11-5-6-3-2-4-7(9)8(6)10-11/h2-5H,9H2,1H3
(5)Std. InChIKey: KNZJAZZOKTUEHM-UHFFFAOYSA-N