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Home > Fluorides > 138679-81-9
138679-81-9 | Benzene, 1-fluoro-3-(trans-4-propylcyclohexyl)-
CAS No: 138679-81-9 Catalog No: AG0018ZQ MDL No:MFCD17014663
Product Description
Catalog Number:
AG0018ZQ
Chemical Name:
Benzene, 1-fluoro-3-(trans-4-propylcyclohexyl)-
CAS Number:
138679-81-9
Molecular Formula:
C15H21F
Molecular Weight:
220.3256
MDL Number:
MFCD17014663
IUPAC Name:
1-fluoro-3-(4-propylcyclohexyl)benzene
InChI:
InChI=1S/C15H21F/c1-2-4-12-7-9-13(10-8-12)14-5-3-6-15(16)11-14/h3,5-6,11-13H,2,4,7-10H2,1H3
InChI Key:
UCPPGQWSQUGPEY-UHFFFAOYSA-N
SMILES:
CCC[C@@H]1CC[C@H](CC1)c1cccc(c1)F
EC Number:
443-100-3
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.163g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.331g/mol
Monoisotopic Mass:
220.163g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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