1,2-bis(ethylthio)ethane

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UUID b08bb30c-d142-486b-ab5a-0e90830ded9c

Flow Object ID fo-c7f38da1b5a7b82e

Source EF 3.1

Context Environmental → Water → Surface water

CAS Numbers 5395-75-5

EC Numbers 226-409-6

prefLabel

Language	Value	Provenance
`en`	`1,2-bis(ethylthio)ethane`

altLabel ⓘ

Language	Value	Provenance
`en`	`1,2-Bis(ethylsulfanyl)ethane`
`en`	`1,2-Di(ethylthio)ethane`
`en`	`3,6-Dithiaoctane`
`en`	`Dimethylenebis(ethyl sulfide)`
`en`	`Ethane, 1,2-bis(ethylthio)-`
`en`	`Ethyl 2-(ethylthio)ethyl sulfide`
`en`	`NSC 2283`

References

Shared Properties

Predicate	Value
InChIKey	`DCXDVGKTBDNYRX-UHFFFAOYSA-N, UCFJGXXKGIAITF-UHFFFAOYSA-N, VOIGMFQJDZTEKW-UHFFFAOYSA-N`
InChI	`InChI=1S/C4H3F6NO/c5-3(6,7)1-12-2(11)4(8,9)10/h11H,1H2, InChI=1S/C6H14S/c1-3-5-6(7)4-2/h6-7H,3-5H2,1-2H3, InChI=1S/C6H14S2/c1-3-7-5-6-8-4-2/h3-6H2,1-2H3`
IUPAC name	`1,2-bis(ethylsulfanyl)ethane, 1,2-bis(ethylthio)ethane, 2,2,2-trifluoroacetimidic acid 2,2,2-trifluoroethyl ester, 2,2,2-trifluoroethanimidic acid 2,2,2-trifluoroethyl ester, 2,2,2-trifluoroethyl 2,2,2-trifluoroethanimidate, 2,2,2-tris(fluoranyl)ethyl 2,2,2-tris(fluoranyl)ethanimidate, 3-hexanethiol, hexane-3-thiol`
Molecular formula	`C4H3F6NO, C6H14S, C6H14S2`
SMILES	`C(C(F)(F)F)OC(=N)C(F)(F)F, CCCC(CC)S, CCSCCSCC`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`b08bb30c-d142-486b-ab5a-0e90830ded9c`	1,2-bis(ethylthio)ethane

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	1,2-bis(ethylthio)ethane	Emissions/Emissions to water/Emissions to fresh water	kg	`exactMatch`	—

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field	Change Count	Latest Time	Transformers	Latest Comment
`altLabel`	1	`—`	consensus_match	group_key=1,2-bis(ethylthio)ethane\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=5395-75-5; added Common Chemistry CAS names as altLabel: 1,2-Bis(ethylsulfanyl)ethane, 1,2-Di(ethylthio)ethane, 3,6-Dithiaoctane, Dimethylenebis(ethyl sulfide), Ethane, 1,2-bis(ethylthio)-, Ethyl 2-(ethylthio)ethyl sulfide, NSC 2283; object_uuid=fo-c7f38da1b5a7b82e
`cas_match_labels`	1	`—`	consensus_match	group_key=1,2-bis(ethylthio)ethane\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'5395-75-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c7f38da1b5a7b82e: {'5395-75-5': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Water
water_body	Surface water

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`None`	[{'@value': '1,2-Bis(ethylsulfanyl)ethane', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:5395-75-5', 'https://commonchemistry.cas.org/detail?cas_rn=5395-75-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,2-Di(ethylthio)ethane', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:5395-75-5', 'https://commonchemistry.cas.org/detail?cas_rn=5395-75-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '3,6-Dithiaoctane', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:5395-75-5', 'https://commonchemistry.cas.org/detail?cas_rn=5395-75-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Dimethylenebis(ethyl sulfide)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:5395-75-5', 'https://commonchemistry.cas.org/detail?cas_rn=5395-75-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Ethane, 1,2-bis(ethylthio)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:5395-75-5', 'https://commonchemistry.cas.org/detail?cas_rn=5395-75-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Ethyl 2-(ethylthio)ethyl sulfide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:5395-75-5', 'https://commonchemistry.cas.org/detail?cas_rn=5395-75-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 2283', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:5395-75-5', 'https://commonchemistry.cas.org/detail?cas_rn=5395-75-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=1,2-bis(ethylthio)ethane\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=5395-75-5; added Common Chemistry CAS names as altLabel: 1,2-Bis(ethylsulfanyl)ethane, 1,2-Di(ethylthio)ethane, 3,6-Dithiaoctane, Dimethylenebis(ethyl sulfide), Ethane, 1,2-bis(ethylthio)-, Ethyl 2-(ethylthio)ethyl sulfide, NSC 2283; object_uuid=fo-c7f38da1b5a7b82e
`cas_match_labels`	`None`	`{'5395-75-5': 'exactMatch'}`	group_key=1,2-bis(ethylthio)ethane\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'5395-75-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c7f38da1b5a7b82e: {'5395-75-5': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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