4-fluoro-2-(hydroxymethyl)benzonitrile


Chemical Name: 4-fluoro-2-(hydroxymethyl)benzonitrile
CAS Number: 1000339-93-4
Product Number: AG0000DD(AGN-PC-058COY)
Synonyms:
MDL No:
Molecular Formula: C8H6FNO
Molecular Weight: 151.1377

Identification/Properties


Computed Properties
Molecular Weight:
151.14g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
151.043g/mol
Monoisotopic Mass:
151.043g/mol
Topological Polar Surface Area:
44A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
174
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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