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Diethyl thiodicarbonate

HCID 76188
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
2905-52-4
Standard SMILES
CCOC(=S)SC(=S)OCC
InChIKey
ALGQDBJUFSYDLA-UHFFFAOYSA-N
Molecular formula
C6H10O2S3
Average molar mass
210.3 g/mol
Monoisotopic mass
209.98429308

Names & identifiers

Preferred name
Diethyl thiodicarbonate
IUPAC
O-ethyl ethoxycarbothioylsulfanylmethanethioate
English name
Bis(ethoxythiocarbonyl)sulfide
Molecular formula
C6H10O2S3
Molecular weight
210.34

Names & synonyms

Diethyl thiodicarbonate2905-52-4Bis(ethoxythiocarbonyl)sulfideO-ethyl ethoxycarbothioylsulfanylmethanethioateo,o-diethyl trithiodicarbonateEINECS 220-808-9BIS-(ETHOXYTHIOCARBONYL)SULFIDESU8BGG88DUbis(ethoxythiocarbonyl)sulfurBis(ethoxythiocarbonyl) sulfidebis(ethoxythiocarbonyl) sulphideSCHEMBL3588443
Show more names
diethylthiodicarbonateBIS(ETHOXYTHIOCARBONYL)SULPHIDEThiobis(thioformic acid ethyl) esterBis-thioformicacidO-ethylester-sulfideBis-(thioformicacidO-ethylester)-sulfide(ethoxycarbothioylthio)methanethioic acid O-ethyl esterα,β-Dithio[α,β-thio]dicarbonic acid Oα,Oβ-diethyl ester
C,C'-Diethyl dicarbonodithioateDTXSID20183288Ethyl carbonodithioate anhydrosulfideXanthic acid, ethyl-, anhydrosulfideDicarbonodithioic acid, C,C'-diethyl esterBis-(thioformic acid O-ethyl ester)-sulfideNS00028612Thiodicarbonic acid ([(HO)C(S)]2-S), diethyl ester

Database identifiers

CAS
2905-52-4
PubChem CID
76188
DTXSID
DTXSID20183288
UNII
SU8BGG88DU
EC Number
220-808-9
Nikkaji
J306.832C

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
108 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
11
Formal charge
0
Complexity
131

Experimental & physicochemical properties

SpringerMaterials PropertiesChemical shift

Physicochemical properties

Melting point
52 · 52-53°C
FDA UNII
8 BGG88DU · SU8BGG88DU
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-36/37/39

Safety & regulation

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

Safety data

risk_code
36/37/38
safety_code
26-36/37/39

Chemistry & industry

Suppliers5 total

Carbone Scientific CO., LTD[email protected]
MDA[email protected]
PFALTZ-BAUER[email protected]
MOLEKULA[email protected]
3B Scientific Corporation[email protected]

Related reactions

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Compound notes

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