Ethanone, 1-(1H-pyrazol-3-yl)-


Chemical Name: Ethanone, 1-(1H-pyrazol-3-yl)-
CAS Number: 20583-33-9
Product Number: AG00BG4D(AGN-PC-0O7JJD)
Synonyms:
MDL No:
Molecular Formula: C5H6N2O
Molecular Weight: 110.1139

Identification/Properties


Computed Properties
Molecular Weight:
110.116g/mol
XLogP3:
0.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
110.048g/mol
Monoisotopic Mass:
110.048g/mol
Topological Polar Surface Area:
45.8A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
103
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:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback