1,4,5,6-Tetrahydropyrrolo[3,4-c]pyrazole supplier

Name
1,4,5,6-Tetrahydropyrrolo[3,4-c]pyrazole
EINECS
CAS No. 769895-06-9
Article Data9
CAS DataBase
Density 1.267 g/cm³
Solubility
Melting Point
Formula C₅H₇N₃
Boiling Point 303.287 °C at 760 mmHg
Molecular Weight 109.131
Flash Point 137.224 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1,4,5,6-Tetrahydropyrrolo[3,4-c]pyrazole;
PSA 40.71000
LogP 0.34170

1,4,5,6-Tetrahydropyrrolo[3,4-c]pyrazole Specification

The 1,4,5,6-Tetrahydropyrrolo[3,4-c]pyrazole is an organic compound with the formula C₅H₇N₃. The systematic name of this chemical is 1,4,5,6-tetrahydropyrrolo[3,4-c]pyrazole. With the CAS registry number 769895-06-9, it is also named as Pyrrolo[3,4-c]pyrazole, 1,4,5,6-tetrahydro-.

Physical properties about 1,4,5,6-Tetrahydropyrrolo[3,4-c]pyrazole are: (1)ACD/LogP: 0.19; (2)ACD/LogD (pH 5.5): -4; (3)ACD/LogD (pH 7.4): -2; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)Polar Surface Area: 40.71 Å²; (11)Index of Refraction: 1.606; (12)Molar Refractivity: 29.688 cm³; (13)Molar Volume: 86.104 cm³; (14)Polarizability: 11.769×10^-24cm³; (15)Surface Tension: 60.384 dyne/cm; (16)Density: 1.267 g/cm³; (17)Flash Point: 137.224 °C; (18)Enthalpy of Vaporization: 54.357 kJ/mol; (19)Boiling Point: 303.287 °C at 760 mmHg; (20)Vapour Pressure: 0.001 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: C1NCc2nncc12
(2)InChI: InChI=1/C5H7N3/c1-4-2-7-8-5(4)3-6-1/h2,6H,1,3H2,(H,7,8)
(3)InChIKey: CVRWHBCQJCUBFE-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C5H7N3/c1-4-2-7-8-5(4)3-6-1/h2,6H,1,3H2,(H,7,8)
(5)Std. InChIKey: CVRWHBCQJCUBFE-UHFFFAOYSA-N

Product Name

1,4,5,6-Tetrahydropyrrolo[3,4-c]pyrazole

1,4,5,6-Tetrahydropyrrolo[3,4-c]pyrazole Specification

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