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Dibismuth Trisulphide

UUID 029241a8-1c47-4713-8f31-32adc4cb9338
Flow Object IDfo-6b597b2318c08eb4
Source EF 3.1
Context Environmental → Ground → Agricultural
CAS Numbers 1345-07-9
EC Numbers 215-716-0
prefLabel
Language Value Provenance
en Dibismuth Trisulphide
altLabel
Language Value Provenance
en AustroTec Bis 84
en BIS 83
en BIS 84
en Bismuth sesquisulfide
en Bismuth sulfide
en Bismuth sulfide (Bi<sub>2</sub>S<sub>3</sub>)
en Bismuth(3+) sulfide
en C.I. 77172
en Dibismuth trisulfide
References
Shared Properties
Predicate Value
InChIKey AZRUTJCZRXDQRH-UHFFFAOYSA-N, DQXQROIYRLCRES-UHFFFAOYSA-N, NWFZLGWPKUUNDG-UHFFFAOYSA-N, PUMXGEVUYOJJEY-UHFFFAOYSA-N, RBWFXUOHBJGAMO-UHFFFAOYSA-N, RJSILSMQHXJVGU-UHFFFAOYSA-N, RKZAYPOPFHHDIL-UHFFFAOYSA-N, WPQBJTWMEYTWKK-UHFFFAOYSA-N, YNRGZHRFBQOYPP-UHFFFAOYSA-N, ZABYETDLLXARHZ-UHFFFAOYSA-N
InChI InChI=1S/2Bi.3H2S/h;;3*1H2, InChI=1S/2Bi.3S, InChI=1S/2Bi.3S/q2*+3;3*-2, InChI=1S/2Bi.S2.S/c;;1-2;, InChI=1S/4Bi.6S, InChI=1S/Bi.S, InChI=1S/Bi.S.H, InChI=1S/Bi.S/q+1;, InChI=1S/C12H17Cl2NO3/c1-11(7-12(11,13)14)10(17)15-5-3-8(4-6-15)9(16)18-2/h8H,3-7H2,1-2H3, InChI=1S/C23H25N5O13/c1-10-8-26(23(33)25-21(10)32)22-18(24-15-6-5-14(27(34)35)7-16(15)28(36)37)20(40-13(4)31)19(39-12(3)30)17(41-22)9-38-11(2)29/h5-8,17-20,22,24H,9H2,1-4H3,(H,25,32,33)
IUPAC name 1-(2,2-dichloro-1-methyl-cyclopropanecarbonyl)isonipecotic acid methyl ester, 1-[(2,2-dichloro-1-methylcyclopropyl)-oxomethyl]-4-piperidinecarboxylic acid methyl ester, 2,4,6,8,9,10-hexathia-1,3,5,7-tetrabismatricyclo[3.3.1.13,7]decane, [3,4-diacetoxy-5-(2,4-dinitroanilino)-6-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydropyran-2-yl]methyl acetate, [3,4-diacetyloxy-5-(2,4-dinitroanilino)-6-(5-methyl-2,4-dioxopyrimidin-1-yl)oxan-2-yl]methyl acetate, [3,4-diacetyloxy-5-[(2,4-dinitrophenyl)amino]-6-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxan-2-yl]methyl ethanoate, acetic acid [3,4-diacetoxy-6-(2,4-diketo-5-methyl-pyrimidin-1-yl)-5-(2,4-dinitroanilino)tetrahydropyran-2-yl]methyl ester, acetic acid [3,4-diacetyloxy-5-(2,4-dinitroanilino)-6-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-oxanyl]methyl ester, dibismuth;trisulfide, methyl 1-(2,2-dichloro-1-methyl-cyclopropanecarbonyl)piperidine-4-carboxylate, methyl 1-(2,2-dichloro-1-methylcyclopropanecarbonyl)piperidine-4-carboxylate, methyl 1-[2,2-bis(chloranyl)-1-methyl-cyclopropyl]carbonylpiperidine-4-carboxylate, sulfanylidene(sulfanylidenebismuthanylsulfanyl)bismuthane, sulfanylidene-(sulfanylidenebismuthinylthio)bismuthine, sulfanylidenebismuth, sulfanylidenebismuthane, sulfanylidenebismuthanylium, sulfanylidenebismuthine, sulfanylidenebismuthinylium, thioxo(thioxobismuthanylsulfanyl)bismuthane, thioxo-(thioxobismuthinylthio)bismuthine, thioxobismuth, thioxobismuthane, thioxobismuthanylium, thioxobismuthine, thioxobismuthinylium
Molecular formula Bi2H6S3, Bi2S3, Bi4S6, BiHS, BiS, BiS+, C12H17Cl2NO3, C23H25N5O13
SMILES CC1(CC1(Cl)Cl)C(=O)N2CCC(CC2)C(=O)OC, CC1=CN(C(=O)NC1=O)C2C(C(C(C(O2)COC(=O)C)OC(=O)C)OC(=O)C)NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-], S.S.S.[Bi].[Bi], S1[Bi]2S[Bi]3S[Bi]1S[Bi](S2)S3, S=S=[Bi].S=[Bi], S=[Bi+], S=[BiH], S=[Bi], S=[Bi]S[Bi]=S, [S-2].[S-2].[S-2].[Bi+3].[Bi+3]

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 029241a8-1c47-4713-8f31-32adc4cb9338 dibismuth trisulphide

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 dibismuth trisulphide Emissions/Emissions to soil/Emissions to agricultural soil 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=dibismuthtrisulphide||dimension=Environmental > media=Ground > geography=Agricultural; cas=1345-07-9; added Common Chemistry CAS names as altLabel: AustroTec Bis 84, BIS 83, BIS 84, Bismuth sesquisulfide, Bismuth sulfide, Bismuth sulfide (Bi<sub>2</sub>S<sub>3</sub>), Bismuth(3+) sulfide, C.I. 77172, Dibismuth trisulfide; object_uuid=fo-6b597b2318c08eb4
cas_match_labels 1 consensus_match group_key=dibismuthtrisulphide||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'1345-07-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6b597b2318c08eb4: {'1345-07-9': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyAgricultural

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': 'AustroTec Bis 84', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1345-07-9', 'https://commonchemistry.cas.org/detail?cas_rn=1345-07-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'BIS 83', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1345-07-9', 'https://commonchemistry.cas.org/detail?cas_rn=1345-07-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'BIS 84', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1345-07-9', 'https://commonchemistry.cas.org/detail?cas_rn=1345-07-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Bismuth sesquisulfide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1345-07-9', 'https://commonchemistry.cas.org/detail?cas_rn=1345-07-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Bismuth sulfide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1345-07-9', 'https://commonchemistry.cas.org/detail?cas_rn=1345-07-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Bismuth sulfide (Bi<sub>2</sub>S<sub>3</sub>)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1345-07-9', 'https://commonchemistry.cas.org/detail?cas_rn=1345-07-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Bismuth(3+) sulfide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1345-07-9', 'https://commonchemistry.cas.org/detail?cas_rn=1345-07-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'C.I. 77172', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1345-07-9', 'https://commonchemistry.cas.org/detail?cas_rn=1345-07-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Dibismuth trisulfide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1345-07-9', 'https://commonchemistry.cas.org/detail?cas_rn=1345-07-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=dibismuthtrisulphide||dimension=Environmental > media=Ground > geography=Agricultural; cas=1345-07-9; added Common Chemistry CAS names as altLabel: AustroTec Bis 84, BIS 83, BIS 84, Bismuth sesquisulfide, Bismuth sulfide, Bismuth sulfide (Bi<sub>2</sub>S<sub>3</sub>), Bismuth(3+) sulfide, C.I. 77172, Dibismuth trisulfide; object_uuid=fo-6b597b2318c08eb4
cas_match_labels None {'1345-07-9': 'exactMatch'} group_key=dibismuthtrisulphide||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'1345-07-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6b597b2318c08eb4: {'1345-07-9': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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  "unit": "kg",
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      "impact_category": "Aquatic eco-toxicity",
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      "characterization_factor": 6.6461
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        "InChI=1S/2Bi.3S/q2*+3;3*-2",
        "InChI=1S/2Bi.S2.S/c;;1-2;",
        "InChI=1S/4Bi.6S",
        "InChI=1S/Bi.S",
        "InChI=1S/Bi.S.H",
        "InChI=1S/Bi.S/q+1;",
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        "1-[(2,2-dichloro-1-methylcyclopropyl)-oxomethyl]-4-piperidinecarboxylic acid methyl ester",
        "2,4,6,8,9,10-hexathia-1,3,5,7-tetrabismatricyclo[3.3.1.13,7]decane",
        "[3,4-diacetoxy-5-(2,4-dinitroanilino)-6-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydropyran-2-yl]methyl acetate",
        "[3,4-diacetyloxy-5-(2,4-dinitroanilino)-6-(5-methyl-2,4-dioxopyrimidin-1-yl)oxan-2-yl]methyl acetate",
        "[3,4-diacetyloxy-5-[(2,4-dinitrophenyl)amino]-6-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxan-2-yl]methyl ethanoate",
        "acetic acid [3,4-diacetoxy-6-(2,4-diketo-5-methyl-pyrimidin-1-yl)-5-(2,4-dinitroanilino)tetrahydropyran-2-yl]methyl ester",
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        "methyl 1-(2,2-dichloro-1-methyl-cyclopropanecarbonyl)piperidine-4-carboxylate",
        "methyl 1-(2,2-dichloro-1-methylcyclopropanecarbonyl)piperidine-4-carboxylate",
        "methyl 1-[2,2-bis(chloranyl)-1-methyl-cyclopropyl]carbonylpiperidine-4-carboxylate",
        "sulfanylidene(sulfanylidenebismuthanylsulfanyl)bismuthane",
        "sulfanylidene-(sulfanylidenebismuthinylthio)bismuthine",
        "sulfanylidenebismuth",
        "sulfanylidenebismuthane",
        "sulfanylidenebismuthanylium",
        "sulfanylidenebismuthine",
        "sulfanylidenebismuthinylium",
        "thioxo(thioxobismuthanylsulfanyl)bismuthane",
        "thioxo-(thioxobismuthinylthio)bismuthine",
        "thioxobismuth",
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        "thioxobismuthanylium",
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