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61794-56-7 | 2,3,5,6-Tetrafluoro-4-(trifluoromethyl)phenylacety lene
CAS No: 61794-56-7 Catalog No: AG01EWNX MDL No:
Product Description
Catalog Number:
AG01EWNX
Chemical Name:
2,3,5,6-Tetrafluoro-4-(trifluoromethyl)phenylacety lene
CAS Number:
61794-56-7
Molecular Formula:
C9HF7
Molecular Weight:
242.0931
IUPAC Name:
1-ethynyl-2,3,5,6-tetrafluoro-4-(trifluoromethyl)benzene
InChI:
InChI=1S/C9HF7/c1-2-3-5(10)7(12)4(9(14,15)16)8(13)6(3)11/h1H
InChI Key:
ZIKCIEVMHMODFF-UHFFFAOYSA-N
SMILES:
C#Cc1c(F)c(F)c(c(c1F)F)C(F)(F)F
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.997g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.096g/mol
Monoisotopic Mass:
241.997g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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