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Name |
2H-Indazole-5-carboxylic acid, 2-methyl-, methyl ester |
EINECS | N/A |
CAS No. | 1092351-86-4 | Density | 1.23 g/cm3 |
PSA | 44.12000 | LogP | 1.35990 |
Solubility | N/A | Melting Point |
N/A |
Formula | C10H10N2O2 | Boiling Point | 338.9 °C at 760 mmHg |
Molecular Weight | 190.2 | Flash Point | 158.8 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
5-Methoxycarbonyl-2-methylindazole;Methyl 2-methylindazole-5-carboxylate;2-Methyl-2H-indazole-5-carboxylic acid methyl ester; |
The 2H-Indazole-5-carboxylic acid, 2-methyl-, methyl ester, with the CAS registry number 1092351-86-4, is also known as 2-Methyl-2H-indazole-5-carboxylic acid methyl ester. This chemical's molecular formula is C10H10N2O2 and molecular weight is 190.2. What's more, its systematic name is methyl 2-methylindazole-5-carboxylate.
Physical properties of 2H-Indazole-5-carboxylic acid, 2-methyl-, methyl ester are: (1)ACD/LogP: 1.79; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.79; (4)ACD/LogD (pH 7.4): 1.79; (5)#H bond acceptors: 4; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 2; (8)Polar Surface Area: 44.12 Å2; (9)Index of Refraction: 1.595; (10)Molar Refractivity: 52.41 cm3; (11)Molar Volume: 154 cm3; (12)Polarizability: 20.77×10-24cm3; (13)Surface Tension: 43 dyne/cm; (14)Density: 1.23 g/cm3; (15)Flash Point: 158.8 °C; (16)Enthalpy of Vaporization: 58.23 kJ/mol; (17)Boiling Point: 338.9 °C at 760 mmHg; (18)Vapour Pressure: 9.5E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CN1C=C2C=C(C=CC2=N1)C(=O)OC
(2)InChI: InChI=1S/C10H10N2O2/c1-12-6-8-5-7(10(13)14-2)3-4-9(8)11-12/h3-6H,1-2H3
(3)InChIKey: ZOXYVIUYSOLWRJ-UHFFFAOYSA-N