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Home > Fluorides > 131819-22-2
131819-22-2 | Benzene, 1,2,3-trifluoro-5-(trans-4-pentylcyclohexyl)-
CAS No: 131819-22-2 Catalog No: AG000ZS0 MDL No:
Product Description
Catalog Number:
AG000ZS0
Chemical Name:
Benzene, 1,2,3-trifluoro-5-(trans-4-pentylcyclohexyl)-
CAS Number:
131819-22-2
Molecular Formula:
C17H23F3
Molecular Weight:
284.3597
IUPAC Name:
1,2,3-trifluoro-5-(4-pentylcyclohexyl)benzene
InChI:
InChI=1S/C17H23F3/c1-2-3-4-5-12-6-8-13(9-7-12)14-10-15(18)17(20)16(19)11-14/h10-13H,2-9H2,1H3
InChI Key:
SBXPWEXVHHTJOO-UHFFFAOYSA-N
SMILES:
CCCCC[C@@H]1CC[C@H](CC1)c1cc(F)c(c(c1)F)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:
284.175g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.366g/mol
Monoisotopic Mass:
284.175g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.2
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