Sulfluramid

C₁₀H₆F₁₇NO₂SCAS 4151-50-2527.20 g/mol

Open in Covalent MOL file

Alkyl halide Sulfonamide

Properties

Molecular formula: C₁₀H₆F₁₇NO₂S
Molar mass: 527.20 g/mol
Exact mass: 526.9848 Da
Melting point: 96 °C
Boiling point: 196 °C
pKa: 9.5
Water solubility: insoluble
logP: 4.89Crippen estimate
Polar surface area: 46.2 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 9

Hazards

Warning

H302+H312 Harmful if swallowed or in contact with skin98.5% of notifiers
H302 Harmful if swallowed98.5% of notifiers
H312 Harmful in contact with skin97.1% of notifiers
H411 Toxic to aquatic life with long lasting effects98.5% of notifiers

Aggregated from 68 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P273, P280, P301+P317, P302+P352, P317, P321, P330, P362+P364, P391, P501

Identifiers

CAS number

4151-50-2

SMILES

CCNS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

InChIKey

CCEKAJIANROZEO-UHFFFAOYSA-N

InChI

InChI=1S/C10H6F17NO2S/c1-2-28-31(29,30)10(26,27)8(21,22)6(17,18)4(13,14)3(11,12)5(15,16)7(19,20)9(23,24)25/h28H,2H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

15 names · show all

1-Octanesulfonamide, N-ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-
N-Ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-1-octanesulfonamide
GX 071
AI 3-29757
FiniTron
N-Ethylperfluorooctanesulfonamide
Alstar
Alstar (pesticide)
N-Ethylperfluorooctylsulfonamide
Mirex S
Volcano
Volcano (insecticide)
FX 12
N-Ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane-1-sulfonamide
Sulfluramide

Work with Sulfluramid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Fluorad FC 1351652-63-756 % similar Perfluorooctanesulfonyl fluoride307-35-747 % similar 1,1,2,2,3,3,4,4,5,5,6,6,6-Tridecafluoro-1-hexanesulfonyl fluoride423-50-747 % similar Tetraethylammonium perfluorooctanesulfonate56773-42-346 % similar Perfluorooctanesulfonic acid1763-23-146 % similar Perfluorohexanesulfonic acid355-46-446 % similar Perfluoroheptanesulfonic acid375-92-846 % similar Perfluorooctanesulfonamide754-91-646 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia