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1H-Indazole-7-carboxylic acid, 1-methyl-, methyl ester

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  • Name 1H-Indazole-7-carboxylic acid, 1-methyl-, methyl ester
  • EINECSN/A
  • CAS No. 1092351-84-2
  • Density1.23 g/cm3
  • PSA44.12000
  • LogP1.35990
  • SolubilityN/A
  • Melting PointN/A
  • FormulaC10H10N2O2
  • Boiling Point313.1 °C at 760 mmHg
  • Molecular Weight190.2
  • Flash Point143.1 °C
  • Transport InformationN/A
  • AppearanceN/A
  • Safety
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 1092351-84-2 (Methyl 1-methylindazole-7-carboxylate)
  • Hazard SymbolsN/A
  • SynonymsN/A

1H-Indazole-7-carboxylic acid, 1-methyl-, methyl ester Specification

The 1H-Indazole-7-carboxylic acid, 1-methyl-, methyl ester, with the CAS registry number 1092351-84-2, is also known as 1-Methyl-1H-indazole-7-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 1-methylindazole-7-carboxylate. 

Physical properties of 1H-Indazole-7-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)Canonical SMILES: CN1C2=C(C=CC=C2C(=O)OC)C=N1
(2)InChI: InChI=1S/C10H10N2O2/c1-12-9-7(6-11-12)4-3-5-8(9)10(13)14-2/h3-6H,1-2H3
(3)InChIKey: ARLZANUTGUOGEG-UHFFFAOYSA-N

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