1-Propanamine, 3,3,3-trifluoro-


Chemical Name: 1-Propanamine, 3,3,3-trifluoro-
CAS Number: 460-39-9
Product Number: AG00D8F3(AGN-PC-0JK9DF)
Synonyms:
MDL No:
Molecular Formula: C3H6F3N
Molecular Weight: 113.0816

Identification/Properties


Computed Properties
Molecular Weight:
113.083g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
113.045g/mol
Monoisotopic Mass:
113.045g/mol
Topological Polar Surface Area:
26A^2
Heavy Atom Count:
7
Formal Charge:
0
Complexity:
48.6
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

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NMR Spectrum


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