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1233513-51-3

1233513-51-3 | 2,3,5-Trifluorophenylacetylene

CAS No: 1233513-51-3 Catalog No: AG01FF0E MDL No:

Product Description

Catalog Number:
AG01FF0E
Chemical Name:
2,3,5-Trifluorophenylacetylene
CAS Number:
1233513-51-3
Molecular Formula:
C8H3F3
Molecular Weight:
156.1046
IUPAC Name:
1-ethynyl-2,3,5-trifluorobenzene
InChI:
InChI=1S/C8H3F3/c1-2-5-3-6(9)4-7(10)8(5)11/h1,3-4H
InChI Key:
FNYZSCSYWRXSAZ-UHFFFAOYSA-N
SMILES:
C#Cc1cc(F)cc(c1F)F

Properties

Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.019g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.107g/mol
Monoisotopic Mass:
156.019g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

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