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5,5'-Thiobis[1,3,4-thiadiazole-2(3H)-thione]

HCID 4446554
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
7340-97-8
Standard SMILES
S=c1[nH]nc(Sc2n[nH]c(=S)s2)s1
InChIKey
HOJIICWYDFQRKH-UHFFFAOYSA-N
Molecular formula
C4H2N4S5
Average molar mass
266.4 g/mol
Monoisotopic mass
265.88830195

Names & identifiers

Preferred name
5,5'-Thiobis[1,3,4-thiadiazole-2(3H)-thione]
IUPAC
5-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)sulfanyl]-3H-1,3,4-thiadiazole-2-thione

Names & synonyms

7340-97-85,5'-Thiobis[1,3,4-thiadiazole-2(3H)-thione]5,5'-Thiobis(1,3,4-thiadiazole-2(3H)-thione)RefChem:2981975-[(5-sulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,4-thiadiazole-2-thiolHOJIICWYDFQRKH-UHFFFAOYSA-NSCHEMBL760613SCHEMBL3186554DTXSID0012553295-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)sulfanyl]-3H-1,3,4-thiadiazole-2-thioneAO-159/373420065,5a(2)-Thiobis[1,3,4-thiadiazole-2(3H)-thione]
Show more names
5,5'-Sulfanediyldi(1,3,4-thiadiazole-2(3H)-thione)

Database identifiers

CAS
7340-97-8
PubChem CID
4446554
DTXSID
DTXSID001255329
EC Number
686-791-9

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
189 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
2
Heavy atoms
13
Formal charge
0
Complexity
301

Experimental & physicochemical properties

Physical DescriptionLiquid

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 · 3 items

This chemical does not meet GHS hazard criteria for 100% (35 of 35) of all reports.

Not Classified

Aggregated GHS information provided per 35 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory Information · 4 items

Chemical: 1,3,4-Thiadiazole-2(3H)-thione, 5,5′-thiobis-

1,3,4-Thiadiazole-2(3H)-thione, 5,5'-thiobis- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,3,4-Thiadiazole-2(3H)-thione, 5,5'-thiobis- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

1,3,4-Thiadiazole-2(3H)-thione, 5,5’-thiobis-: Non hazardous

Hazard Classes and CategoriesNot Classified

Chemistry & industry

Uses & manufacturing

U.S. Production2023: <50,000 lb
Industry UsesLubricating agent
General Manufacturing Information · 2 items

Petroleum Lubricating Oil and Grease Manufacturing

1,3,4-Thiadiazole-2(3H)-thione, 5,5'-thiobis-: ACTIVE

Related reactions

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Compound notes

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