[2-(trifluoromethyl)pyridin-3-yl]methanol


Chemical Name: [2-(trifluoromethyl)pyridin-3-yl]methanol
CAS Number: 131747-57-4
Product Number: AG000ZOD(AGN-PC-002GHA)
Synonyms:
MDL No:
Molecular Formula: C7H6F3NO
Molecular Weight: 177.1238

Identification/Properties


Computed Properties
Molecular Weight:
177.126g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
177.04g/mol
Monoisotopic Mass:
177.04g/mol
Topological Polar Surface Area:
33.1A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
148
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:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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