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1443354-32-2 | Cycloheptyl (2,4,5-trifluorophenyl)methanol
CAS No: 1443354-32-2 Catalog No: AG01FB22 MDL No:
Product Description
Catalog Number:
AG01FB22
Chemical Name:
Cycloheptyl (2,4,5-trifluorophenyl)methanol
CAS Number:
1443354-32-2
Molecular Formula:
C14H17F3O
Molecular Weight:
258.2794
IUPAC Name:
cycloheptyl-(2,4,5-trifluorophenyl)methanol
InChI:
InChI=1S/C14H17F3O/c15-11-8-13(17)12(16)7-10(11)14(18)9-5-3-1-2-4-6-9/h7-9,14,18H,1-6H2
InChI Key:
GFSMKMCPUIHBHD-UHFFFAOYSA-N
SMILES:
OC(c1cc(F)c(cc1F)F)C1CCCCCC1
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.123g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
258.284g/mol
Monoisotopic Mass:
258.123g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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