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4-Mesyl-2-nitrotoluene

UUID e27e4536-298d-4ab7-bb03-7458d0b6229a
Deprecated yes
Replaced By 9cf35094-7ac4-40c0-acd3-aed3fa36fbef
Flow Object IDfo-ff04071150d85ad6
Source EF 3.1
Context Environmental → Ground → Unknown
CAS Numbers 1671-49-4
EC Numbers 430-550-0
prefLabel
Language Value Provenance
en 4-Mesyl-2-nitrotoluene
altLabel ⓘ
Language Value Provenance
en 1-Methyl-4-methylsulfonyl-2-nitrobenzene
en 2-Nitro-4-methanesulfone toluene
en 2-Nitro-4-methylsulfone toluene
en 2-Nitro-4-methylsulfonyltoluene
en 4-Methylsulfonyl-1-methyl-2-nitrobenzene
en 4-Methylsulfonyl-2-nitrotoluene
en Benzene, 1-methyl-4-(methylsulfonyl)-2-nitro-
en Sulfone, methyl 3-nitro-<em>p</em>-tolyl
en 1-methyl-4-(methylsulfonyl)-2-nitrobenzene
References
Shared Properties
Predicate Value
InChIKey OXBDLEXAVKAJFD-UHFFFAOYSA-N
InChI InChI=1S/C8H9NO4S/c1-6-3-4-7(14(2,12)13)5-8(6)9(10)11/h3-5H,1-2H3
IUPAC name 1-methyl-4-methylsulfonyl-2-nitro-benzene, 1-methyl-4-methylsulfonyl-2-nitrobenzene, 4-mesyl-1-methyl-2-nitro-benzene
Molecular formula C8H9NO4S
SMILES CC1=C(C=C(C=C1)S(=O)(=O)C)[N+](=O)[O-]

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 e27e4536-298d-4ab7-bb03-7458d0b6229a 1-methyl-4-(methylsulfonyl)-2-nitrobenzene

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-methyl-4-(methylsulfonyl)-2-nitrobenzene||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=1671-49-4; added Common Chemistry CAS names as altLabel: 1-Methyl-4-methylsulfonyl-2-nitrobenzene, 2-Nitro-4-methanesulfone toluene, 2-Nitro-4-methylsulfone toluene, 2-Nitro-4-methylsulfonyltoluene, 4-Methylsulfonyl-1-methyl-2-nitrobenzene, 4-Methylsulfonyl-2-nitrotoluene, Benzene, 1-methyl-4-(methylsulfonyl)-2-nitro-, Sulfone, methyl 3-nitro-<em>p</em>-tolyl; object_uuid=fo-ff04071150d85ad6
cas_match_labels 1 — consensus_match group_key=1-methyl-4-(methylsulfonyl)-2-nitrobenzene||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['pubchem']; cas_sources={'1671-49-4': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ff04071150d85ad6: {'1671-49-4': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyUnknown

Consensus Changes

Field Old Value New Value Comment
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cas_match_labels None {'1671-49-4': 'exactMatch'} group_key=1-methyl-4-(methylsulfonyl)-2-nitrobenzene||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['pubchem']; cas_sources={'1671-49-4': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ff04071150d85ad6: {'1671-49-4': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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