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83168-09-6 | Phenol, 2-fluoro-4-(trans-4-propylcyclohexyl)-
CAS No: 83168-09-6 Catalog No: AG004VP7 MDL No:
Product Description
Catalog Number:
AG004VP7
Chemical Name:
Phenol, 2-fluoro-4-(trans-4-propylcyclohexyl)-
CAS Number:
83168-09-6
Molecular Formula:
C15H21FO
Molecular Weight:
236.3250
IUPAC Name:
2-fluoro-4-(4-propylcyclohexyl)phenol
InChI:
InChI=1S/C15H21FO/c1-2-3-11-4-6-12(7-5-11)13-8-9-15(17)14(16)10-13/h8-12,17H,2-7H2,1H3
InChI Key:
PVKOISIMZOLKSR-UHFFFAOYSA-N
SMILES:
CCC[C@@H]1CC[C@H](CC1)c1ccc(c(c1)F)O
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.158g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
236.33g/mol
Monoisotopic Mass:
236.158g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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