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59843-77-5

59843-77-5 structural image
Product Name: 3-(3-NITROPHENYL)PYRAZOLE
Formula: C9H7N3O2
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 11.7 [ug/mL] (The mean of the results at pH 7.4)

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Skull and Crossbones
Acute Toxicity
GHS06
GHS Hazard Statements H301:Acute toxicity,oral
Precautionary Statement Codes P301+P310:IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.

COMPUTED DESCRIPTORS

Molecular Weight 189.17 g/mol
XLogP3 1.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 189.053826475 g/mol
Monoisotopic Mass 189.053826475 g/mol
Topological Polar Surface Area 74.5 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 217
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes