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123812-84-0 | Cyclobutene, 3-(trifluoromethyl)-
CAS No: 123812-84-0 Catalog No: AG000L4B MDL No:
Product Description
Catalog Number:
AG000L4B
Chemical Name:
Cyclobutene, 3-(trifluoromethyl)-
CAS Number:
123812-84-0
Molecular Formula:
C5H5F3
Molecular Weight:
122.0884
IUPAC Name:
3-(trifluoromethyl)cyclobutene
InChI:
InChI=1S/C5H5F3/c6-5(7,8)4-2-1-3-4/h1-2,4H,3H2
InChI Key:
HZNKQWVKCVCPKU-UHFFFAOYSA-N
SMILES:
FC(C1CC=C1)(F)F
Properties
Complexity:
111
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
122.034g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
122.09g/mol
Monoisotopic Mass:
122.034g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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