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1H-Indazole-4-carboxylic acid, 1-methyl-, methyl ester

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Name

1H-Indazole-4-carboxylic acid, 1-methyl-, methyl ester

EINECS N/A
CAS No. 1071428-42-6 Density 1.23 g/cm3
PSA 44.12000 LogP 1.35990
Solubility N/A Melting Point N/A
Formula C10H10N2O2 Boiling Point 313.1 °C at 760 mmHg
Molecular Weight 190.2 Flash Point 143.1 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 1071428-42-6 (Methyl 1-methylindazole-4-carboxylate) Hazard Symbols N/A
Synonyms

4-Methoxycarbonyl-1-methylindazole;1-Methyl-1H-indazole-4-carboxylic acid methyl ester;Methyl 1-methylindazole-4-carboxylate;

 

1H-Indazole-4-carboxylic acid, 1-methyl-, methyl ester Specification

The 1H-Indazole-4-carboxylic acid, 1-methyl-, methyl ester, with the CAS registry number 1071428-42-6, is also known as 4-Methoxycarbonyl-1-methylindazole. This chemical's molecular formula is C10H10N2O2 and molecular weight is 190.2. What's more, its systematic name is methyl 1-methylindazole-4-carboxylate. 

Physical properties of 1H-Indazole-4-carboxylic acid, 1-methyl-, methyl ester are: (1)ACD/LogP: 1.91; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.91; (4)ACD/LogD (pH 7.4): 1.91; (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: 143.1 °C ; (16)Enthalpy of Vaporization: 55.41 kJ/mol; (17)Boiling Point: 313.1 °C at 760 mmHg; (18)Vapour Pressure: 0.000508 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: COC(=O)c2cccc1c2cnn1C
(2)InChI: InChI=1S/C10H10N2O2/c1-12-9-5-3-4-7(10(13)14-2)8(9)6-11-12/h3-6H,1-2H3
(3)InChIKey: XSFSEOKZIRNPQO-UHFFFAOYSA-N

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