Methanesulfonic acid,1,1,1-trifluoro-, 1-cycloocten-1-yl ester

Modify Date: 2025-08-25 17:52:56

Methanesulfonic acid,1,1,1-trifluoro-, 1-cycloocten-1-yl ester Structure
Methanesulfonic acid,1,1,1-trifluoro-, 1-cycloocten-1-yl ester structure
Common Name Methanesulfonic acid,1,1,1-trifluoro-, 1-cycloocten-1-yl ester
CAS Number 28075-35-6 Molecular Weight 258.25800
Density 1.33g/cm3 Boiling Point 284ºC at 760mmHg
Molecular Formula C9H13F3O3S Melting Point N/A
MSDS N/A Flash Point 125.6ºC

 Names

Name [(1E)-cycloocten-1-yl] trifluoromethanesulfonate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.33g/cm3
Boiling Point 284ºC at 760mmHg
Molecular Formula C9H13F3O3S
Molecular Weight 258.25800
Flash Point 125.6ºC
Exact Mass 258.05400
PSA 51.75000
LogP 4.17150
Vapour Pressure 0.00523mmHg at 25°C
Index of Refraction 1.451
InChIKey YLZNQFXAEQJJNR-SOFGYWHQSA-N
SMILES O=S(=O)(OC1=CCCCCCC1)C(F)(F)F

 Synthetic Route

~74%

Methanesulfonic acid,1,1,1-trifluoro-, 1-cycloocten-1-yl ester Structure

Methanesulfonic...

CAS#:28075-35-6

Literature: Scheiper, Bodo; Bonnekessel, Melanie; Krause, Helga; Fuerstner, Alois Journal of Organic Chemistry, 2004 , vol. 69, # 11 p. 3943 - 3949

~67%

Methanesulfonic acid,1,1,1-trifluoro-, 1-cycloocten-1-yl ester Structure

Methanesulfonic...

CAS#:28075-35-6

Literature: Arcadi, Antonio; Cacchi, Sandro; Marinelli, Fabio Tetrahedron, 1993 , vol. 49, # 22 p. 4955 - 4964

~80%

Methanesulfonic acid,1,1,1-trifluoro-, 1-cycloocten-1-yl ester Structure

Methanesulfonic...

CAS#:28075-35-6

Literature: Mc Murray, John E.; Scott, William J. Tetrahedron Letters, 1983 , vol. 24, # 10 p. 979 - 982

~40%

Methanesulfonic acid,1,1,1-trifluoro-, 1-cycloocten-1-yl ester Structure

Methanesulfonic...

CAS#:28075-35-6

Literature: Dueber, T. E.; Stang, P. J.; Pfeifer, W. D.; et al. Angewandte Chemie, 1970 , vol. 9, p. 521 - 522 Angewandte Chemie, 1970 , vol. 82, p. 517 - 518

 Bioassay

View more

Name: Compound was studied in P388 test system for the antitumor activity expressed as perc...
Source: ChEMBL
Target: P388
External Id: CHEMBL757002
Name: Compound was studied in P388 test system for the antitumor activity expressed as perc...
Source: ChEMBL
Target: P388
External Id: CHEMBL758357
Name: Compound was studied in P388 test system for the antitumor activity expressed as numb...
Source: ChEMBL
Target: P388
External Id: CHEMBL759614
Name: HIV Cellular Data
Source: NIAID
Target: N/A
External Id: HIV Cellular Data
Name: Compound was studied in P388 test system for the antitumor activity expressed as numb...
Source: ChEMBL
Target: P388
External Id: CHEMBL759612
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 Synonyms

1-cyclooctenyl triflate
1-cyclooctenyltrifluoromethanesulfonate
Cycloocten-1-triflat
trifluoromethanesulfonic acid cyclooct-1-enyl ester
1-Cycloocten-1-yl trifluoromethanesulfonate
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