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Home > Fluorides > 117081-47-7
117081-47-7 | Naphthalene, 1-(1,1,2,2,2-pentafluoroethyl)-
CAS No: 117081-47-7 Catalog No: AG000DOQ MDL No:
Product Description
Catalog Number:
AG000DOQ
Chemical Name:
Naphthalene, 1-(1,1,2,2,2-pentafluoroethyl)-
CAS Number:
117081-47-7
Molecular Formula:
C12H7F5
Molecular Weight:
246.1760
IUPAC Name:
1-(1,1,2,2,2-pentafluoroethyl)naphthalene
InChI:
InChI=1S/C12H7F5/c13-11(14,12(15,16)17)10-7-3-5-8-4-1-2-6-9(8)10/h1-7H
InChI Key:
DXXOLVRYTMVSFQ-UHFFFAOYSA-N
SMILES:
FC(C(c1cccc2c1cccc2)(F)F)(F)F
Properties
Complexity:
271
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.047g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.18g/mol
Monoisotopic Mass:
246.047g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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