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1-Hydroxypyrazole

1-Hydroxypyrazole structure

1-Hydroxypyrazole 

structure
  • CAS No:

    81945-73-5

  • Formula:

    C3H4N2O

  • Chemical Name:

    1-Hydroxypyrazole

  • Synonyms:

    1H-Pyrazole,1-hydroxy-;1-Hydroxy-1H-pyrazole;1-Hydroxypyrazole;N-Hydroxypyrazole;Pyrazol-1-ol;1H-Pyrazol-1-ol;126248-89-3;169382-96-1

1-Hydroxypyrazole Basic Attributes

84.08

84.08

279-854-3

2933199090

Characteristics

38

0.3

1.3±0.1 g/cm3

74 °C

242.3°C at 760 mmHg

100.3±22.6 °C

1.588

Safety Information

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

1-Hydroxypyrazole Use and Manufacturing

N-[6-(2-Hydroxy-2H-pyrazol-3-yl)-2, 4-dioxo-7-trifluoromethyl-l, 4-dihydro-2H-quinazolin-3-yl]-methanesulfonamide; Pyrazol-1-ol; OHHVi N O.A mixture of pyrazole (10 g, 147 mmol) and mCPBA (36.2 g, 147 mmol) in AcOEt (500 mL) was stirred at r.t. for 1O d. The solution was concentrated in vacuo to afford a yellow paste which was extracted with water (6 x 100 mL) and coned HCl (100 mL). The aqueous phase was washed with DCM (2 x 100 mL). The organic layers were combined, concentrated in vacuo and extracted with coned HCl (50 mL). The aqueous phases were combined and 115 g of trisodium phosphate dodecahydrate were added followed by NaOH until pH 10. The aqueous phase was concentrated in vacuo to a volume of 400 mL and was then extracted in continue with OCMfEt

Computed Properties

Molecular Weight:84.08
XLogP3:0.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Exact Mass:84.032362755
Monoisotopic Mass:84.032362755
Topological Polar Surface Area:38
Heavy Atom Count:6
Complexity:48.1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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