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410544-19-3

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Basic Information
CAS No.: 410544-19-3
Name: 4,5,6,7-TETRAHYDRO-1H-PYRAZOLO[4,3-C]PYRIDINE
Article Data: 4
Molecular Structure:
Molecular Structure of 410544-19-3 (4,5,6,7-TETRAHYDRO-1H-PYRAZOLO[4,3-C]PYRIDINE)
Formula: C6H9N3
Molecular Weight: 123.158
Synonyms: 2H-Pyrazolo[4,3-c]pyridine, 4,5,6,7-tetrahydro-;
Density: 1.186 g/cm3
Boiling Point: 331.7 °C at 760 mmHg
Flash Point: 154.4 °C
PSA: 40.71000
LogP: 0.38420
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Specification

The 1H-Pyrazolo[4,3-c]pyridine, 4,5,6,7-tetrahydro-, with the CAS registry number 410544-19-3, is also known as 2H-Pyrazolo[4,3-c]pyridine, 4,5,6,7-tetrahydro-. This chemical's molecular formula is C6H9N3 and molecular weight is 123.1558. What's more, its systematic name is called 4,5,6,7-Tetrahydro-1H-pyrazolo[4,3-c]pyridine.

Physical properties about 1H-Pyrazolo[4,3-c]pyridine, 4,5,6,7-tetrahydro- are: (1)ACD/LogP: -0.50; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.5; (4)ACD/LogD (pH 7.4): -2.31; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 21.06 Å2; (13)Index of Refraction: 1.574; (14)Molar Refractivity: 34.29 cm3; (15)Molar Volume: 103.8 cm3; (16)Polarizability: 13.59×10-24 cm3; (17)Surface Tension: 52.9 dyne/cm; (18)Density: 1.186 g/cm3; (19)Flash Point: 154.4 °C; (20)Enthalpy of Vaporization: 57.44 kJ/mol; (21)Boiling Point: 331.7 °C at 760 mmHg; (22)Vapour Pressure: 0.000153 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: n1cc2c(n1)CCNC2
(2) InChI: InChI=1/C6H9N3/c1-2-7-3-5-4-8-9-6(1)5/h4,7H,1-3H2,(H,8,9)
(3) InChIKey: VGMJQHONPAXABH-UHFFFAOYAB