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Calcium Bis[4-({1-[(2-chlorophenyl)carbamoyl]-2-oxopropyl}diazenyl)-3-nitrobenzenesulfonate]

UUID d7de7b90-7c07-48f3-9431-f0224cf858d3
Flow Object IDfo-46b4f063634c7add
Source EF 3.1
Context Environmental → Air → Unknown
CAS Numbers 71832-85-4
EC Numbers 276-057-2
prefLabel
Language Value Provenance
en Calcium Bis[4-({1-[(2-chlorophenyl)carbamoyl]-2-oxopropyl}diazenyl)-3-nitrobenzenesulfonate]
altLabel
Language Value Provenance
en Benzenesulfonic acid, 4-[2-[1-[[(2-chlorophenyl)amino]carbonyl]-2-oxopropyl]diazenyl]-3-nitro-, calcium salt (2:1)
en Benzenesulfonic acid, 4-[[1-[[(2-chlorophenyl)amino]carbonyl]-2-oxopropyl]azo]-3-nitro-, calcium salt (2:1)
en C.I. 13960
en C.I. Pigment Yellow 168
en C.I. Pigment Yellow 68
en Irgalite Yellow WGP
en Irgazin DPP Orange
en PY 168
en Paliotol Yellow K 1070
en Pigment Yellow 168
en Yellow K 1070
References
Shared Properties
Predicate Value
InChIKey DDCADXXYNNJKIV-UHFFFAOYSA-J, HNZWXYKISSJTJE-UHFFFAOYSA-M, JKJJPMXYDHJAIS-UHFFFAOYSA-N, UKIYXKYOUKPFOL-UHFFFAOYSA-N, VAIFZRVTOUVLAW-UHFFFAOYSA-L, VHYMEUSEXOYUAW-UHFFFAOYSA-N, YERDDXWHERDHGJ-UHFFFAOYSA-N
InChI InChI=1S/2C16H13ClN4O7S.Ca.2H2/c2*1-9(22)15(16(23)18-12-5-3-2-4-11(12)17)20-19-13-7-6-10(29(26,27)28)8-14(13)21(24)25;;;/h2*2-8,15H,1H3,(H,18,23)(H,26,27,28);;2*1H, InChI=1S/2C16H13ClN4O7S.Ca/c2*1-9(22)15(16(23)18-12-5-3-2-4-11(12)17)20-19-13-7-6-10(29(26,27)28)8-14(13)21(24)25;/h2*2-8,15H,1H3,(H,18,23)(H,26,27,28);, InChI=1S/2C16H13ClN4O7S.Ca/c2*1-9(22)15(16(23)18-12-5-3-2-4-11(12)17)20-19-13-7-6-10(29(26,27)28)8-14(13)21(24)25;/h2*2-8,15H,1H3,(H,18,23)(H,26,27,28);/q;;+2/p-2, InChI=1S/4C16H13ClN4O7S.Ca/c4*1-9(22)15(16(23)18-12-5-3-2-4-11(12)17)20-19-13-7-6-10(29(26,27)28)8-14(13)21(24)25;/h4*2-8,15H,1H3,(H,18,23)(H,26,27,28);/q;;;;+2/p-4, InChI=1S/C16H13ClN4O7S.Ca/c1-9(22)15(16(23)18-12-5-3-2-4-11(12)17)20-19-13-7-6-10(29(26,27)28)8-14(13)21(24)25;/h2-8,15H,1H3,(H,18,23)(H,26,27,28);, InChI=1S/C16H13ClN4O7S.Ca/c1-9(22)15(16(23)18-12-5-3-2-4-11(12)17)20-19-13-7-6-10(29(26,27)28)8-14(13)21(24)25;/h2-8,15H,1H3,(H,18,23)(H,26,27,28);/q;+2/p-1, InChI=1S/C17H13NO4/c1-2-22-17(21)18-10-7-8-13-14(9-10)16(20)12-6-4-3-5-11(12)15(13)19/h3-9H,2H2,1H3,(H,18,21)
IUPAC name N-(9,10-diketo-2-anthryl)carbamic acid ethyl ester, N-(9,10-dioxo-2-anthracenyl)carbamic acid ethyl ester, calcium 4-[1-(2-chloroanilino)-1,3-dioxobutan-2-yl]azo-3-nitrobenzenesulfonate, calcium 4-[1-[(2-chlorophenyl)carbamoyl]-2-keto-propyl]azo-3-nitro-besylate, calcium 4-[1-[(2-chlorophenyl)carbamoyl]-2-oxo-propyl]azo-3-nitro-benzenesulfonate, calcium 4-[[1-(2-chloroanilino)-1,3-dioxobutan-2-yl]diazenyl]-3-nitrobenzenesulfonate, calcium 4-[[1-[(2-chlorophenyl)amino]-1,3-bis(oxidanylidene)butan-2-yl]diazenyl]-3-nitro-benzenesulfonate, calcium bis(4-[1-(2-chloroanilino)-1,3-dioxobutan-2-yl]azo-3-nitrobenzenesulfonate), calcium bis(4-[1-[(2-chlorophenyl)carbamoyl]-2-keto-propyl]azo-3-nitro-besylate), calcium bis(4-[1-[(2-chlorophenyl)carbamoyl]-2-oxo-propyl]azo-3-nitro-benzenesulfonate), calcium bis(4-[[1-(2-chloroanilino)-1,3-dioxobutan-2-yl]diazenyl]-3-nitrobenzenesulfonate), calcium bis(4-[[1-[(2-chlorophenyl)amino]-1,3-bis(oxidanylidene)butan-2-yl]diazenyl]-3-nitro-benzenesulfonate), calcium tetrakis(4-[1-(2-chloroanilino)-1,3-dioxobutan-2-yl]azo-3-nitrobenzenesulfonate), calcium tetrakis(4-[1-[(2-chlorophenyl)carbamoyl]-2-keto-propyl]azo-3-nitro-besylate), calcium tetrakis(4-[1-[(2-chlorophenyl)carbamoyl]-2-oxo-propyl]azo-3-nitro-benzenesulfonate), calcium tetrakis(4-[[1-(2-chloroanilino)-1,3-dioxobutan-2-yl]diazenyl]-3-nitrobenzenesulfonate), calcium tetrakis(4-[[1-[(2-chlorophenyl)amino]-1,3-bis(oxidanylidene)butan-2-yl]diazenyl]-3-nitro-benzenesulfonate), ethyl N-(9,10-dioxo-2-anthryl)carbamate, ethyl N-(9,10-dioxoanthracen-2-yl)carbamate, ethyl N-[9,10-bis(oxidanylidene)anthracen-2-yl]carbamate
Molecular formula C16H12CaClN4O7S+, C16H13CaClN4O7S, C17H13NO4, C32H24CaCl2N8O14S2, C32H26CaCl2N8O14S2, C32H30CaCl2N8O14S2, C64H48CaCl4N16O28S4-2
SMILES CC(=O)C(C(=O)NC1=CC=CC=C1Cl)N=NC2=C(C=C(C=C2)S(=O)(=O)O)[N+](=O)[O-].CC(=O)C(C(=O)NC1=CC=CC=C1Cl)N=NC2=C(C=C(C=C2)S(=O)(=O)O)[N+](=O)[O-].[Ca], CC(=O)C(C(=O)NC1=CC=CC=C1Cl)N=NC2=C(C=C(C=C2)S(=O)(=O)O)[N+](=O)[O-].[Ca], CC(=O)C(C(=O)NC1=CC=CC=C1Cl)N=NC2=C(C=C(C=C2)S(=O)(=O)[O-])[N+](=O)[O-].CC(=O)C(C(=O)NC1=CC=CC=C1Cl)N=NC2=C(C=C(C=C2)S(=O)(=O)[O-])[N+](=O)[O-].CC(=O)C(C(=O)NC1=CC=CC=C1Cl)N=NC2=C(C=C(C=C2)S(=O)(=O)[O-])[N+](=O)[O-].CC(=O)C(C(=O)NC1=CC=CC=C1Cl)N=NC2=C(C=C(C=C2)S(=O)(=O)[O-])[N+](=O)[O-].[Ca+2], CC(=O)C(C(=O)NC1=CC=CC=C1Cl)N=NC2=C(C=C(C=C2)S(=O)(=O)[O-])[N+](=O)[O-].CC(=O)C(C(=O)NC1=CC=CC=C1Cl)N=NC2=C(C=C(C=C2)S(=O)(=O)[O-])[N+](=O)[O-].[Ca+2], CC(=O)C(C(=O)NC1=CC=CC=C1Cl)N=NC2=C(C=C(C=C2)S(=O)(=O)[O-])[N+](=O)[O-].[Ca+2], CCOC(=O)NC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O, [HH].[HH].CC(=O)C(C(=O)NC1=CC=CC=C1Cl)N=NC2=C(C=C(C=C2)S(=O)(=O)O)[N+](=O)[O-].CC(=O)C(C(=O)NC1=CC=CC=C1Cl)N=NC2=C(C=C(C=C2)S(=O)(=O)O)[N+](=O)[O-].[Ca]

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 d7de7b90-7c07-48f3-9431-f0224cf858d3 calcium bis[4-({1-[(2-chlorophenyl)carbamoyl]-2-oxopropyl}diazenyl)-3-nitrobenzenesulfonate]

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 calcium bis[4-({1-[(2-chlorophenyl)carbamoyl]-2-oxopropyl}diazenyl)-3-nitrobenzenesulfonate] Emissions/Emissions to air/Emissions to air, unspecified 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=calciumbis[4-({1-[(2-chlorophenyl)carbamoyl]-2-oxopropyl}diazenyl)-3-nitrobenzenesulfonate]||dimension=Environmental > media=Ground > geography=Agricultural; cas=71832-85-4; added Common Chemistry CAS names as altLabel: Benzenesulfonic acid, 4-[2-[1-[[(2-chlorophenyl)amino]carbonyl]-2-oxopropyl]diazenyl]-3-nitro-, calcium salt (2:1), Benzenesulfonic acid, 4-[[1-[[(2-chlorophenyl)amino]carbonyl]-2-oxopropyl]azo]-3-nitro-, calcium salt (2:1), C.I. 13960, C.I. Pigment Yellow 168, C.I. Pigment Yellow 68, Irgalite Yellow WGP, Irgazin DPP Orange, PY 168, Paliotol Yellow K 1070, Pigment Yellow 168, Yellow K 1070; object_uuid=fo-46b4f063634c7add
cas_match_labels 1 consensus_match group_key=calciumbis[4-({1-[(2-chlorophenyl)carbamoyl]-2-oxopropyl}diazenyl)-3-nitrobenzenesulfonate]||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory']; cas_sources={'71832-85-4': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-46b4f063634c7add: {'71832-85-4': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaAir
strataUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': 'Benzenesulfonic acid, 4-[2-[1-[[(2-chlorophenyl)amino]carbonyl]-2-oxopropyl]diazenyl]-3-nitro-, calcium salt (2:1)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:71832-85-4', 'https://commonchemistry.cas.org/detail?cas_rn=71832-85-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzenesulfonic acid, 4-[[1-[[(2-chlorophenyl)amino]carbonyl]-2-oxopropyl]azo]-3-nitro-, calcium salt (2:1)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:71832-85-4', 'https://commonchemistry.cas.org/detail?cas_rn=71832-85-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'C.I. 13960', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:71832-85-4', 'https://commonchemistry.cas.org/detail?cas_rn=71832-85-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'C.I. Pigment Yellow 168', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:71832-85-4', 'https://commonchemistry.cas.org/detail?cas_rn=71832-85-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'C.I. Pigment Yellow 68', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:71832-85-4', 'https://commonchemistry.cas.org/detail?cas_rn=71832-85-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Irgalite Yellow WGP', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:71832-85-4', 'https://commonchemistry.cas.org/detail?cas_rn=71832-85-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Irgazin DPP Orange', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:71832-85-4', 'https://commonchemistry.cas.org/detail?cas_rn=71832-85-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'PY 168', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:71832-85-4', 'https://commonchemistry.cas.org/detail?cas_rn=71832-85-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Paliotol Yellow K 1070', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:71832-85-4', 'https://commonchemistry.cas.org/detail?cas_rn=71832-85-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Pigment Yellow 168', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:71832-85-4', 'https://commonchemistry.cas.org/detail?cas_rn=71832-85-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Yellow K 1070', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:71832-85-4', 'https://commonchemistry.cas.org/detail?cas_rn=71832-85-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=calciumbis[4-({1-[(2-chlorophenyl)carbamoyl]-2-oxopropyl}diazenyl)-3-nitrobenzenesulfonate]||dimension=Environmental > media=Ground > geography=Agricultural; cas=71832-85-4; added Common Chemistry CAS names as altLabel: Benzenesulfonic acid, 4-[2-[1-[[(2-chlorophenyl)amino]carbonyl]-2-oxopropyl]diazenyl]-3-nitro-, calcium salt (2:1), Benzenesulfonic acid, 4-[[1-[[(2-chlorophenyl)amino]carbonyl]-2-oxopropyl]azo]-3-nitro-, calcium salt (2:1), C.I. 13960, C.I. Pigment Yellow 168, C.I. Pigment Yellow 68, Irgalite Yellow WGP, Irgazin DPP Orange, PY 168, Paliotol Yellow K 1070, Pigment Yellow 168, Yellow K 1070; object_uuid=fo-46b4f063634c7add
cas_match_labels None {'71832-85-4': 'exactMatch'} group_key=calciumbis[4-({1-[(2-chlorophenyl)carbamoyl]-2-oxopropyl}diazenyl)-3-nitrobenzenesulfonate]||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory']; cas_sources={'71832-85-4': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-46b4f063634c7add: {'71832-85-4': '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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