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2,7-Naphthalenedisulfonic acid, 4,4'-[(6-chloro-1,3,5-triazine-2,4-diyl)diimino]bis[5-hydroxy-6-[2-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]diazenyl]-, sodium salt (1:6)

UUID 6f602802-cd06-4cb3-a1b1-e445dac3b39c
Flow Object IDfo-518ec3e1d3cbf051
Source EF 3.1
Context Environmental → Air → Ground level → Rural (<1000 people/square mile)
CAS Numbers 94158-79-9
EC Numbers 303-152-9
prefLabel
Language Value Provenance
en 2,7-Naphthalenedisulfonic acid, 4,4'-[(6-chloro-1,3,5-triazine-2,4-diyl)diimino]bis[5-hydroxy-6-[2-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]diazenyl]-, sodium salt (1:6)
altLabel ⓘ
Language Value Provenance
en 2,7-Naphthalenedisulfonic acid, 4,4′-[(6-chloro-1,3,5-triazine-2,4-diyl)diimino]bis[5-hydroxy-6-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]azo]-, sodium salt
en 4,4'-[(6-chloro-1,3,5-triazine-2,4-diyl)diimino]bis[5-hydroxy-6-[[4-[[2-(sulphooxy)ethyl]sulphonyl]phenyl]azo]naphthalene-2,7-disulphonic] Acid, Sodium Salt
References
Shared Properties
Predicate Value
InChIKey LPICDELXXFHFOX-UHFFFAOYSA-H
InChI InChI=1S/C39H32ClN9O26S8.6Na/c40-37-43-38(41-27-17-25(78(56,57)58)13-19-15-29(80(62,63)64)33(35(50)31(19)27)48-46-21-1-5-23(6-2-21)76(52,53)11-9-74-82(68,69)70)45-39(44-37)42-28-18-26(79(59,60)61)14-20-16-30(81(65,66)67)34(36(51)32(20)28)49-47-22-3-7-24(8-4-22)77(54,55)12-10-75-83(71,72)73;;;;;;/h1-8,13-18,50-51H,9-12H2,(H,56,57,58)(H,59,60,61)(H,62,63,64)(H,65,66,67)(H,68,69,70)(H,71,72,73)(H2,41,42,43,44,45);;;;;;/q;6*+1/p-6
IUPAC name hexasodium;5-[[4-chloranyl-6-[[8-oxidanyl-3,6-disulfonato-7-[[4-(2-sulfonatooxyethylsulfonyl)phenyl]diazenyl]naphthalen-1-yl]amino]-1,3,5-triazin-2-yl]amino]-4-oxidanyl-3-[[4-(2-sulfonatooxyethylsulfonyl)phenyl]diazenyl]naphthalene-2,7-disulfonate, hexasodium;5-[[4-chloro-6-[[8-hydroxy-3,6-disulfonato-7-[4-(2-sulfonatooxyethylsulfonyl)phenyl]azo-1-naphthalenyl]amino]-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[4-(2-sulfonatooxyethylsulfonyl)phenyl]azonaphthalene-2,7-disulfonate, hexasodium;5-[[4-chloro-6-[[8-hydroxy-3,6-disulfonato-7-[4-(2-sulfonatooxyethylsulfonyl)phenyl]azo-1-naphthyl]amino]-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[4-(2-sulfonatooxyethylsulfonyl)phenyl]azo-naphthalene-2,7-disulfonate, hexasodium;5-[[4-chloro-6-[[8-hydroxy-3,6-disulfonato-7-[[4-(2-sulfonatooxyethylsulfonyl)phenyl]diazenyl]naphthalen-1-yl]amino]-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[[4-(2-sulfonatooxyethylsulfonyl)phenyl]diazenyl]naphthalene-2,7-disulfonate, hexasodium;5-[[4-chloro-6-[[8-hydroxy-7-[4-(2-sulfatoethylsulfonyl)phenyl]azo-3,6-disulfonato-1-naphthyl]amino]-s-triazin-2-yl]amino]-4-hydroxy-3-[4-(2-sulfatoethylsulfonyl)phenyl]azo-naphthalene-2,7-disulfonate
Molecular formula C39H26ClN9Na6O26S8
SMILES C1=CC(=CC=C1N=NC2=C(C3=C(C=C(C=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])NC4=NC(=NC(=N4)Cl)NC5=C6C(=CC(=C5)S(=O)(=O)[O-])C=C(C(=C6O)N=NC7=CC=C(C=C7)S(=O)(=O)CCOS(=O)(=O)[O-])S(=O)(=O)[O-])O)S(=O)(=O)CCOS(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 6f602802-cd06-4cb3-a1b1-e445dac3b39c 4,4'-[(6-chloro-1,3,5-triazine-2,4-diyl)diimino]bis[5-hydroxy-6-[[4-[[2-(sulphooxy)ethyl]sulphonyl]phenyl]azo]naphthalene-2,7-disulphonic] acid, sodium salt

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 4,4'-[(6-chloro-1,3,5-triazine-2,4-diyl)diimino]bis[5-hydroxy-6-[[4-[[2-(sulphooxy)ethyl]sulphonyl]phenyl]azo]naphthalene-2,7-disulphonic] acid, sodium salt Emissions/Emissions to air/Emissions to air, unspecified (long-term) 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=4,4'-[(6-chloro-1,3,5-triazine-2,4-diyl)diimino]bis[5-hydroxy-6-[[4-[[2-(sulphooxy)ethyl]sulphonyl]phenyl]azo]naphthalene-2,7-disulphonic]acid,sodiumsalt||dimension=Environmental > media=Ground > geography=Agricultural; cas=94158-79-9; added Common Chemistry CAS names as altLabel: 2,7-Naphthalenedisulfonic acid, 4,4′-[(6-chloro-1,3,5-triazine-2,4-diyl)diimino]bis[5-hydroxy-6-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]azo]-, sodium salt; object_uuid=fo-518ec3e1d3cbf051
cas_match_labels 1 — consensus_match group_key=4,4'-[(6-chloro-1,3,5-triazine-2,4-diyl)diimino]bis[5-hydroxy-6-[[4-[[2-(sulphooxy)ethyl]sulphonyl]phenyl]azo]naphthalene-2,7-disulphonic]acid,sodiumsalt||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory']; cas_sources={'94158-79-9': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-518ec3e1d3cbf051: {'94158-79-9': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaAir
strataGround level
population_densityRural (<1000 people/square mile)

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '2,7-Naphthalenedisulfonic acid, 4,4′-[(6-chloro-1,3,5-triazine-2,4-diyl)diimino]bis[5-hydroxy-6-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]azo]-, sodium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94158-79-9', 'https://commonchemistry.cas.org/detail?cas_rn=94158-79-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=4,4'-[(6-chloro-1,3,5-triazine-2,4-diyl)diimino]bis[5-hydroxy-6-[[4-[[2-(sulphooxy)ethyl]sulphonyl]phenyl]azo]naphthalene-2,7-disulphonic]acid,sodiumsalt||dimension=Environmental > media=Ground > geography=Agricultural; cas=94158-79-9; added Common Chemistry CAS names as altLabel: 2,7-Naphthalenedisulfonic acid, 4,4′-[(6-chloro-1,3,5-triazine-2,4-diyl)diimino]bis[5-hydroxy-6-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]azo]-, sodium salt; object_uuid=fo-518ec3e1d3cbf051
cas_match_labels None {'94158-79-9': 'exactMatch'} group_key=4,4'-[(6-chloro-1,3,5-triazine-2,4-diyl)diimino]bis[5-hydroxy-6-[[4-[[2-(sulphooxy)ethyl]sulphonyl]phenyl]azo]naphthalene-2,7-disulphonic]acid,sodiumsalt||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory']; cas_sources={'94158-79-9': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-518ec3e1d3cbf051: {'94158-79-9': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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