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Home > Fluorides > 119266-76-1
119266-76-1 | Cyclohexene, 1-fluoro-4-(trans-4-pentylcyclohexyl)-
CAS No: 119266-76-1 Catalog No: AG000IH3 MDL No:
Product Description
Catalog Number:
AG000IH3
Chemical Name:
Cyclohexene, 1-fluoro-4-(trans-4-pentylcyclohexyl)-
CAS Number:
119266-76-1
Molecular Formula:
C17H29F
Molecular Weight:
252.4106
IUPAC Name:
1-fluoro-4-(4-pentylcyclohexyl)cyclohexene
InChI:
InChI=1S/C17H29F/c1-2-3-4-5-14-6-8-15(9-7-14)16-10-12-17(18)13-11-16/h12,14-16H,2-11,13H2,1H3
InChI Key:
WCXILYWKRCISHU-UHFFFAOYSA-N
SMILES:
CCCCC[C@@H]1CC[C@H](CC1)C1CCC(=CC1)F
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.225g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.417g/mol
Monoisotopic Mass:
252.225g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
7
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