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2,2'-Dithiobis(N,N-dimethylethanamine)

HCID 28485
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Basic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
1072-11-3
Standard SMILES
CN(C)CCSSCCN(C)C
InChIKey
BAEWLQWSDPXZDM-UHFFFAOYSA-N
Molecular formula
C8H20N2S2
Average molar mass
208.4 g/mol
Monoisotopic mass
208.10679099

Overview

RN given refers to parent cpd

Names & identifiers

Preferred name
2,2'-Dithiobis(N,N-dimethylethanamine)
IUPAC
2-[2-(dimethylamino)ethyldisulfanyl]-N,N-dimethylethanamine
English name
Bis[2-(dimethylamino)ethyl] persulfide
Molecular formula
C8H20N2S2
Molecular weight
208.39

Names & synonyms

1072-11-3N,N-TetramethylcystamineVHF51F4YIWDTXSID301479322,2'-DITHIOBIS(N,N-DIMETHYLETHANAMINE)RefChem:908495DTXCID2070423TMTSEthanamine, 2,2'-dithiobis[N,N-dimethyl-2-[2-(dimethylamino)ethyldisulfanyl]-N,N-dimethylethanamineBis[2-(dimethylamino)ethyl] persulfideEthanamine, 2,2'-dithiobis(N,N-dimethyl-
Show more names
Bis(2-dimethylaminoethyl) persulfideN,N,N',N'-Tetramethyl[2,2'-dithiobisethanamine]2-[2-(dimethylazaniumyl)ethyldisulfanyl]ethyl-dimethylazanium dichloride
(2-{[2-(dimethylamino)ethyl]disulfanyl}ethyl)dimethylamine2,2'-disulfanediylbis(N,N-dimethylethanamine)NSC-101840Bis(dimethylaminoethyl)disulfideNSC 101840UNII-VHF51F4YIWTETRAMETHYLCYSTAMINENCIOpen2_004842

Database identifiers

CAS
1072-11-3
PubChem CID
28485
DTXSID
DTXSID30147932
UNII
VHF51F4YIW
EC Number
600-802-6
Nikkaji
J60.920J

Properties

Computed structural properties

XLogP
1
Topological polar surface area
57.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
12
Formal charge
0
Complexity
85.1

Physicochemical properties

Boiling point
230 · 230-235 °C
Density
1.026 · 1.026±0.06 g/cm3(Predicted)
pka
9.08 · 9.08±0.28(Predicted)
FDA UNII
51 F4YIW · VHF51F4YIW

Chemistry & industry

Upstream & downstream products

Upstream raw materials

Ethanol, 2,2'-dithiobis-, 1,1'-dimethanesulfonateThiosulfuric acid,S-[2-(dimethylamino)ethyl] esterMethanamine, N,N'-dithiobis[N-methyl-Cystamine dihydrochlorideDimethylamine2-(Dimethylamino)ethanethiolEthyleneFormaldehyde2-Dimethylaminoethanethiol hydrochloride2-Dimethylaminoethyl chloride hydrochloride2-Chloroethyldimethylamine

Downstream products

Glutathione

Suppliers1 total

CLEARSYNTH LABS LTD.+91-22-45045900 · [email protected]

Related reactions

1 records
New reaction record
HRID 1082323 reaction equation
HRID 1082323As productuspto-grants-1996_12

Compound notes

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