CAS
696-02-6 Purity
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696-02-6 Purity
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3,4,5-Trifluorophenylacetylene
Catalog Number
ACMA00001557
Category
Aryl
Molecular Weight
156.10
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Specification
Hazard Statements
H315-H318-H335-H410
RIDADR
NONH for all modes of transport
Symbol
GHS05
What is the molecular formula of 3,4,5-Trifluorophenylacetylene?
The molecular formula is C8H3F3.
What is the molecular weight of 3,4,5-Trifluorophenylacetylene?
The molecular weight is 156.10 g/mol.
What is the IUPAC name of 3,4,5-Trifluorophenylacetylene?
The IUPAC name is 5-ethynyl-1,2,3-trifluorobenzene.
What is the InChI of 3,4,5-Trifluorophenylacetylene?
The InChI is InChI=1S/C8H3F3/c1-2-5-3-6(9)8(11)7(10)4-5/h1,3-4H.
What is the InChIKey of 3,4,5-Trifluorophenylacetylene?
The InChIKey is BZXWRVPVZZZAKB-UHFFFAOYSA-N.
What is the canonical SMILES of 3,4,5-Trifluorophenylacetylene?
The canonical SMILES is C#CC1=CC(=C(C(=C1)F)F)F.
What is the CAS number of 3,4,5-Trifluorophenylacetylene?
The CAS number is 158816-55-8.
What is the EC number of 3,4,5-Trifluorophenylacetylene?
The EC number is 692-023-3.
Is 3,4,5-Trifluorophenylacetylene a canonicalized compound?
Yes, it is canonicalized according to PubChem.
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