Benzene, 5-ethynyl-1,2,3-trifluoro-


Chemical Name: Benzene, 5-ethynyl-1,2,3-trifluoro-
CAS Number: 158816-55-8
Product Number: AG003ANE(AGN-PC-03TNHM)
Synonyms:
MDL No:
Molecular Formula: C8H3F3
Molecular Weight: 156.1046

Identification/Properties


Computed Properties
Molecular Weight:
156.107g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
156.019g/mol
Monoisotopic Mass:
156.019g/mol
Topological Polar Surface Area:
0A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
169
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#:
1993
Hazard Statements:
H226-H315-H319
Precautionary Statements:
P305+P351+P338
Class:
3
Packing Group:

NMR Spectrum


Other Analytical Data


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