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Home > Fluorides > 131929-90-3
131929-90-3 | Methanesulfonic acid, 1,1,1-trifluoro-, cyclohexyl ester
CAS No: 131929-90-3 Catalog No: AG000ZXH MDL No:MFCD25957935
Product Description
Catalog Number:
AG000ZXH
Chemical Name:
Methanesulfonic acid, 1,1,1-trifluoro-, cyclohexyl ester
CAS Number:
131929-90-3
Molecular Formula:
C7H11F3O3S
Molecular Weight:
232.2206
MDL Number:
MFCD25957935
IUPAC Name:
cyclohexyl trifluoromethanesulfonate
InChI:
InChI=1S/C7H11F3O3S/c8-7(9,10)14(11,12)13-6-4-2-1-3-5-6/h6H,1-5H2
InChI Key:
VHLRUGZSAQKKLU-UHFFFAOYSA-N
SMILES:
FC(S(=O)(=O)OC1CCCCC1)(F)F
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.038g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.217g/mol
Monoisotopic Mass:
232.038g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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