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Home > Fluorides > 144977-47-9
144977-47-9 | Benzene, 1-fluoro-2-methyl-4-(3,3,5,5-tetramethyl-1-cyclohexen-1-yl)-
CAS No: 144977-47-9 Catalog No: AG001KEG MDL No:MFCD01631308
Product Description
Catalog Number:
AG001KEG
Chemical Name:
Benzene, 1-fluoro-2-methyl-4-(3,3,5,5-tetramethyl-1-cyclohexen-1-yl)-
CAS Number:
144977-47-9
Molecular Formula:
C17H23F
Molecular Weight:
246.3629
MDL Number:
MFCD01631308
IUPAC Name:
1-fluoro-2-methyl-4-(3,3,5,5-tetramethylcyclohexen-1-yl)benzene
InChI:
InChI=1S/C17H23F/c1-12-8-13(6-7-15(12)18)14-9-16(2,3)11-17(4,5)10-14/h6-9H,10-11H2,1-5H3
InChI Key:
DGWOCNOIHNULTH-UHFFFAOYSA-N
SMILES:
Cc1cc(ccc1F)C1=CC(CC(C1)(C)C)(C)C
Properties
Complexity:
338
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.178g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.369g/mol
Monoisotopic Mass:
246.178g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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