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2,2,7,7-Tetramethyl-3,6-dithia-2,7-disilaoctane

HCID 101207
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Basic information

CAS
51048-29-4
Standard SMILES
C[Si](C)(C)SCCS[Si](C)(C)C
InChIKey
CBRFJNLREFDKBD-UHFFFAOYSA-N
Molecular formula
C8H22S2Si2
Average molar mass
238.6 g/mol
Monoisotopic mass
238.07014612

Names & identifiers

Preferred name
2,2,7,7-Tetramethyl-3,6-dithia-2,7-disilaoctane
IUPAC
trimethyl(2-trimethylsilylsulfanylethylsulfanyl)silane
English name
1,2-Ethanedithiobis(trimethylsilane)
Molecular formula
C8H22S2Si2
Molecular weight
238.56

Names & synonyms

51048-29-42,2,7,7-Tetramethyl-3,6-dithia-2,7-disilaoctane1,2-Bis(trimethylsilylthio)ethaneVHT6NH5F65EINECS 256-935-1NSC-382146DTXSID501990543,6-Dithia-2,7-disilaoctane, 2,2,7,7-tetramethyl-NSC 3821461,2-BIS(TRIMETHYLSILANYLSULFANYL)ETHANERefChem:80929DTXCID80121545
Show more names
1,2-ETHANEDITHIOBIS(TRIMETHYSILANE)(Ethylenebisthio)bis(trimethylsilane)S,S'-BIS(TRIMETHYLSILYL)-1,2-ETHANEDITHIOL(1,2-Ethanediylbisthio)bis(trimethylsilane)1,2-Bis(trimethylsilylthio)ethane1,2-Ethanedithiobis(trimethylsilane)
256-935-11,2-Ethanedithiobis(trimethylsilane)Ethylenedithiobis(trimethylsilane)trimethyl(2-trimethylsilylsulfanylethylsulfanyl)silaneMFCD00042832Ethylenedithiobis(trimethylsilane) [Protecting Reagent for Aldehydes and Ketones]S02820C8H22S2Si2

Database identifiers

CAS
51048-29-4
PubChem CID
101207
DTXSID
DTXSID50199054
UNII
VHT6NH5F65
EC Number
256-935-1
Nikkaji
J261.620C

Properties

Computed structural properties

Topological polar surface area
50.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
5
Heavy atoms
12
Formal charge
0
Complexity
108

Physicochemical properties

Boiling point
93 · 93-94 °C0.5 mm Hg(lit.)
Density
0.928 g/mL · 0.928 g/mL at 20 °C(lit.)
refractive index
20 · n20/D 1.495
Flash point
67 °C · 67 °C
form
clear liquid
color
Colorless to Almost colorless
Specific Gravity
0.928 · 0.928
BRN
2037789 · 2037789
InChI
1S/C8H22S2Si2/c1-11(2,3)9-7-8-10-12(4,5)6/h7-8H2,1-6H3
InChIKey
CBRFJNLREFDKBD-UHFFFAOYSA-N
SMILES
C[Si](C)(C)SCCS[Si](C)(C)C
FDA UNII
6 NH5F65 · VHT6NH5F65
UNSPSC Code
12352100 · 12352100
NACRES
22 · NA.22
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
227 · H227-H315-H319

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H227 (50%): Combustible liquid [Warning Flammable liquids]

P210, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesFlam. Liq. 4 (50%)

Safety data

F
10-13-21
PPE
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
wgk
3
ridadr
UN 3334
hs_code
2931.90.9010
Signal word
Warning
Symbol(GHS)
GHS07
safety_code
23-24/25
Storage Class
10 - Combustible liquids
Hazard statements
H227-H315-H319
Precautionary statements
P210-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P370+P378-P403+P235-P501

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
Precautionary statements
210 · P210-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P370+P378-P403+P235-P501
PPE
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
Safety Statements
23 · 23-24/25
RIDADR
3334 · UN 3334
WGK Germany
3 · 3
F
10 · 10-13-21
HS Code
2931.9 · 2931.90.9010
Storage Class
10 · 10 - Combustible liquids