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1478-73-5 | Acetic acid, 2,2,2-trifluoro-, cyclooctyl ester
CAS No: 1478-73-5 Catalog No: AG001F89 MDL No:
Product Description
Catalog Number:
AG001F89
Chemical Name:
Acetic acid, 2,2,2-trifluoro-, cyclooctyl ester
CAS Number:
1478-73-5
Molecular Formula:
C10H15F3O2
Molecular Weight:
224.2201
IUPAC Name:
cyclooctyl 2,2,2-trifluoroacetate
InChI:
InChI=1S/C10H15F3O2/c11-10(12,13)9(14)15-8-6-4-2-1-3-5-7-8/h8H,1-7H2
InChI Key:
AXWMFWDPPKYELQ-UHFFFAOYSA-N
SMILES:
O=C(C(F)(F)F)OC1CCCCCCC1
NSC Number:
73715
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.102g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.223g/mol
Monoisotopic Mass:
224.102g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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