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Home > Fluorides > 146558-44-3
146558-44-3 | Benzene, 1-(2,2-dimethyl-1-methylenepropyl)-3-fluoro-
CAS No: 146558-44-3 Catalog No: AG001E4W MDL No:
Product Description
Catalog Number:
AG001E4W
Chemical Name:
Benzene, 1-(2,2-dimethyl-1-methylenepropyl)-3-fluoro-
CAS Number:
146558-44-3
Molecular Formula:
C12H15F
Molecular Weight:
178.2459
IUPAC Name:
1-(3,3-dimethylbut-1-en-2-yl)-3-fluorobenzene
InChI:
InChI=1S/C12H15F/c1-9(12(2,3)4)10-6-5-7-11(13)8-10/h5-8H,1H2,2-4H3
InChI Key:
AGFFWVOXOGOEID-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)C(=C)C(C)(C)C
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.116g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.25g/mol
Monoisotopic Mass:
178.116g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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