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131929-89-0 | Methanesulfonic acid, 1,1,1-trifluoro-, cyclopentyl ester
CAS No: 131929-89-0 Catalog No: AG000ZXI MDL No:MFCD26130464
Product Description
Catalog Number:
AG000ZXI
Chemical Name:
Methanesulfonic acid, 1,1,1-trifluoro-, cyclopentyl ester
CAS Number:
131929-89-0
Molecular Formula:
C6H9F3O3S
Molecular Weight:
218.1941
MDL Number:
MFCD26130464
IUPAC Name:
cyclopentyl trifluoromethanesulfonate
InChI:
InChI=1S/C6H9F3O3S/c7-6(8,9)13(10,11)12-5-3-1-2-4-5/h5H,1-4H2
InChI Key:
PZSMRYIWZCBSRQ-UHFFFAOYSA-N
SMILES:
FC(S(=O)(=O)OC1CCCC1)(F)F
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.022g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.19g/mol
Monoisotopic Mass:
218.022g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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