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Home > Fluorides > 158536-00-6
158536-00-6 | 1-(Pentafluoroethyl)-4-propyl-benzene
CAS No: 158536-00-6 Catalog No: AG01EU9R MDL No:MFCD23701351
Product Description
Catalog Number:
AG01EU9R
Chemical Name:
1-(Pentafluoroethyl)-4-propyl-benzene
CAS Number:
158536-00-6
Molecular Formula:
C11H11F5
Molecular Weight:
238.1971
MDL Number:
MFCD23701351
IUPAC Name:
1-(1,1,2,2,2-pentafluoroethyl)-4-propylbenzene
InChI:
InChI=1S/C11H11F5/c1-2-3-8-4-6-9(7-5-8)10(12,13)11(14,15)16/h4-7H,2-3H2,1H3
InChI Key:
OMWVMLZLLHLICL-UHFFFAOYSA-N
SMILES:
CCCc1ccc(cc1)C(C(F)(F)F)(F)F
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.078g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.201g/mol
Monoisotopic Mass:
238.078g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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