Benzeneacetonitrile, 3-fluoro-4-methyl-


Chemical Name: Benzeneacetonitrile, 3-fluoro-4-methyl-
CAS Number: 261951-73-9
Product Number: AG002S6P(AGN-PC-0KKWAF)
Synonyms:
MDL No:
Molecular Formula: C9H8FN
Molecular Weight: 149.1649

Identification/Properties


Computed Properties
Molecular Weight:
149.168g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
149.064g/mol
Monoisotopic Mass:
149.064g/mol
Topological Polar Surface Area:
23.8A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
170
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:
Danger
UN#:
2811
Hazard Statements:
H301+H311+H331
Precautionary Statements:
P261-P280-P301+P310-P311
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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