3H-Pyrazol-3-one, 2-(3-chlorophenyl)-2,4-dihydro-5-methyl-


Chemical Name: 3H-Pyrazol-3-one, 2-(3-chlorophenyl)-2,4-dihydro-5-methyl-
CAS Number: 90-31-3
Product Number: AG006FP6(AGN-PC-0JL7AX)
Synonyms:
MDL No:
Molecular Formula: C10H9ClN2O
Molecular Weight: 208.6443

Identification/Properties


Properties
MP:
128-131 °C(lit.)
Storage:
2-8℃;Keep in dry area;
Form:
Solid
Computed Properties
Molecular Weight:
208.645g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
208.04g/mol
Monoisotopic Mass:
208.04g/mol
Topological Polar Surface Area:
32.7A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
277
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

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
3077
Hazard Statements:
H317-H411
Precautionary Statements:
P273-P280
Class:
9
Packing Group:

NMR Spectrum


Other Analytical Data


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