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1001519-28-3

1001519-28-3 structural image
Product Name: N-(2-Aminoethyl)-1-ethyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Formula: C9H13F3N4O
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COMPUTED DESCRIPTORS

Molecular Weight 250.22 g/mol
XLogP3 0.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 250.10414554 g/mol
Monoisotopic Mass 250.10414554 g/mol
Topological Polar Surface Area 72.9 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 272
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