1H-Pyrazolo[3,4-d]pyrimidine supplier

Name
1H-Pyrazolo[3,4-d]pyrimidine
EINECS
CAS No. 271-80-7
Density 1.472g/cm³
Solubility
Melting Point 213-214 °C
Formula C₅H₄N₄
Boiling Point 312.5°C at 760 mmHg
Molecular Weight 120.114
Flash Point 158.7°C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1H-PYRAZOLO[3,4-D]PYRIMIDINE;1H-Pyrazolo[3,4-d]pyrimidine (6CI,8CI,9CI);pyrazolo(3,4-d)pyrimidine
PSA 54.46000
LogP 0.35290

1H-Pyrazolo[3,4-d]pyrimidine Specification

The 1H-Pyrazolo[3,4-d]pyrimidine has CAS registry number 271-80-7. It belongs to the product category of Pyrimidine. This chemical's molecular formula is C₅H₄N₄ and molecular weight is 120.11. What's more, its IUPAC name is 1H-pyrazolo[3,4-d]pyrimidine.

Physical properties of 1H-Pyrazolo[3,4-d]pyrimidine are: (1)ACD/LogP: -0.742; (2)ACD/LogD (pH 5.5): -0.74; (3)ACD/LogD (pH 7.4): -0.74; (4)#H bond acceptors: 4; (5)#Freely Rotating Bonds: 0; (6)#H bond donors: 1; (7)Polar Surface Area: 43.6.

You can still convert the following datas into molecular structure:
(1)SMILES: n1cc2c(nc1)nnc2
(2)Std. InChI: InChI=1S/C5H4N4/c1-4-2-8-9-5(4)7-3-6-1/h1-3H,(H,6,7,8,9)
(3)Std. InChIKey: QUKPALAWEPMWOS-UHFFFAOYSA-N

Product Name

1H-Pyrazolo[3,4-d]pyrimidine

1H-Pyrazolo[3,4-d]pyrimidine Specification

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