Bis(1-piperidinylthioxomethyl) hexasulfide

C₁₂H₂₀N₂S₈CAS 971-15-3448.79 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₂H₂₀N₂S₈
Molar mass: 448.79 g/mol
Exact mass: 447.9392 Da
Melting point: 135–136 °C
logP: 6.50Crippen estimate
Polar surface area: 6.5 Å²
H-bond donors / acceptors: 0 / 8
Rotatable bonds: 5

Hazards

H413 May cause long lasting harmful effects to aquatic life19.4% of notifiers

Aggregated from 253 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P273, P501

Identifiers

CAS number

971-15-3

SMILES

S=C(SSSSSSC(=S)N1CCCCC1)N1CCCCC1

InChIKey

HPFHYRNETZEPIV-UHFFFAOYSA-N

InChI

InChI=1S/C12H20N2S8/c15-11(13-7-3-1-4-8-13)17-19-21-22-20-18-12(16)14-9-5-2-6-10-14/h1-10H2

Weigh it out

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

Names and synonyms

7 names

Hexasulfide, bis(1-piperidinylthioxomethyl)
Hexasulfide, bis(piperidinothiocarbonyl)
Piperidine, 1,1′-(hexathiodicarbonothioyl)bis-
Dipentamethylenethiuram hexasulfide
Robac P 25
Bis(pentamethylene thiuram) hexasulfide
Bostex 224

Work with Bis(1-piperidinylthioxomethyl) hexasulfide

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Dipentamethylenethiuram tetrasulfide120-54-795 % similar Tetrabutylthiuram disulfide1634-02-254 % similar 1-Piperidinethiocarboxamide14294-09-839 % similar Tetraethylthiuram disulfide97-77-839 % similar Tetraisobutylthiuram disulfide3064-73-135 % similar Tetrabenzylthiuram disulfide10591-85-232 % similar Piperidinium piperidinedithiocarbamate98-77-132 % similar Ammonium 1-pyrrolidinedithiocarboxylate5108-96-332 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook