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2,2',2'',2'''-(1,2-Ethanediylidenetetrakis(thio))tetraacetic acid

HCID 82285
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
10003-69-7
Standard SMILES
O=C(O)CSC(SCC(=O)O)C(SCC(=O)O)SCC(=O)O
InChIKey
AWLPPBSWOMXWGA-UHFFFAOYSA-N
Molecular formula
C10H14O8S4
Average molar mass
390.5 g/mol
Monoisotopic mass
389.95715209

Names & identifiers

Preferred name
2,2',2'',2'''-(1,2-Ethanediylidenetetrakis(thio))tetraacetic acid
IUPAC
2-[1,2,2-tris(carboxymethylsulfanyl)ethylsulfanyl]acetic acid
English name
(Ethanediylidenetetrathio)tetraacetic acid
Molecular formula
C10H14O8S4
Molecular weight
390.47

Names & synonyms

Acetic acid, 2,2',2'',2'''-[1,2-ethanediylidenetetrakis(thio)]tetrakis-EINECS 232-998-0DTXSID90648912,2',2'',2'''-(1,2-Ethanediylidenetetrakis(thio))tetraacetic acidAcetic acid, 2,2',2'',2'''-(1,2-ethanediylidenetetrakis(thio))tetrakis-2,2',2'',2'''-[1,2-ethanediylidenetetrakis(thio)]tetraacetic acidRefChem:439975DTXCID7032472232-998-010003-69-7ETTA2-[1,2,2-tris(carboxymethylsulfanyl)ethylsulfanyl]acetic acid
Show more names
(Ethanediylideneetrathio)tertaaceticacid(ETHANEDIYLIDENETETRATHIO)TETRAACETIC ACID 99%(Ethanediylidenetetrathio)tetraacetic acid,99%[1,2-ethanediylidenetetrakis(thio)]tetrakisacetic acid2,2’,2’’,2’’’-[1,2-ethanediylidenetetrakis(thio)]tetrakis-aceticaci
(ETHANEDIYLIDENETETRATHIO)TETRAACETIC ACIDAWLPPBSWOMXWGA-UHFFFAOYSA-NSCHEMBL503348NS000229322,2',2'',2'''-[Ethane-1,1,2,2-tetrayltetrakis(sulfanediyl)]tetraacetic acid2,2',2''2'''-(1,2-ETHANEDIYLIDENE-tetrakis[THIO])-tetrakis-ACETIC ACID3,6-Dithiaoctanedioic acid, 4,5-bis(carboxymethylthio)- (SS'S''S'''-Ethanediylidenetetrakis(thioacetic acid))-

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
250 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
12
Rotatable bonds
13
Heavy atoms
22
Formal charge
0
Complexity
342

Physicochemical properties

Melting point
196 · 196-201 °C
Boiling point
485.68 °C · 485.68°C (rough estimate)
Density
1.7138 · 1.7138 (rough estimate)
refractive index
1.6 · 1.6000 (estimate)
EPA Substance Registry System
2 · Acetic acid, 2,2',2'',2'''-[1,2-ethanediylidenetetrakis(thio)]tetrakis- (10003-69-7)
Symbol(GHS)
5 · GHS05
Signal word
Danger
Hazard statements
314 · H314
Precautionary statements
260 · P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
Hazard Codes
Xi,C
Risk Statements
36 · 36/37/38-34
Safety Statements
37 · 37/39-26-45-36/37/39-27-23
RIDADR
1759 · 1759
TSCA
TSCA listed
HazardClass

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

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Corr. 1B (100%)

Safety data

tsca
TSCA listed
ridadr
1759
risk_code
36/37/38-34
Signal word
Danger
Symbol(GHS)
GHS05
hazard_code
Xi,C
safety_code
37/39-26-45-36/37/39-27-23
hazard_class
8
packing_group
III
Hazard statements
H314
Precautionary statements
P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationAcetic acid, 2,2',2'',2'''-[1,2-ethanediylidenetetrakis(thio)]tetrakis-: INACTIVE

Suppliers1 total

陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
10003-69-7
PubChem CID
82285
DTXSID
DTXSID9064891
EC Number
232-998-0
Nikkaji
J241.214D
8 · 8
PackingGroup
III