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Home > Fluorides > 833447-14-6
833447-14-6 | Cyclopentane, [3-[(trifluoromethyl)sulfonyl]-2-propynyl]-
CAS No: 833447-14-6 Catalog No: AG004X8Y MDL No:
Product Description
Catalog Number:
AG004X8Y
Chemical Name:
Cyclopentane, [3-[(trifluoromethyl)sulfonyl]-2-propynyl]-
CAS Number:
833447-14-6
Molecular Formula:
C9H11F3O2S
Molecular Weight:
240.2426
IUPAC Name:
3-(trifluoromethylsulfonyl)prop-2-ynylcyclopentane
InChI:
InChI=1S/C9H11F3O2S/c10-9(11,12)15(13,14)7-3-6-8-4-1-2-5-8/h8H,1-2,4-6H2
InChI Key:
WSXISGYMMRPMJC-UHFFFAOYSA-N
SMILES:
FC(S(=O)(=O)C#CCC1CCCC1)(F)F
Properties
Complexity:
371
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.043g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.24g/mol
Monoisotopic Mass:
240.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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