2-chloro-3-methyl-4-(methylsulfonyl) Benzoic Acid

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2-chloro-3-methyl-4-(methylsulfonyl) Benzoic Acid

UUID d150092a-7ba0-4677-8e17-0e972fd2d1b5

Flow Object ID fo-f4a6aef12e8c0fd1

Source EF 3.1

Context Environmental → Air → Ground level → Urban (>1000 people/square mile)

CAS Numbers 106904-09-0

EC Numbers 600-786-0

prefLabel

Language	Value	Provenance
`en`	`2-chloro-3-methyl-4-(methylsulfonyl) Benzoic Acid`

altLabel ⓘ

Language	Value	Provenance
`en`	`2-Chloro-3-methyl-4-(methylsulfonyl)benzoic acid`
`en`	`2-Chloro-3-methyl-4-methanesulfonyl benzoic acid`
`en`	`2-Chloro-3-methyl-4-methylsulfonylbenzoic acid`
`en`	`2-Chloro-4-methanesulfonyl-3-methylbenzoic acid`
`en`	`Benzoic acid, 2-chloro-3-methyl-4-(methylsulfonyl)-`

References

Shared Properties

Predicate	Value
InChIKey	`FPKXNAFZBMSRNR-UHFFFAOYSA-N, RRFGGUXLGOVPOP-UHFFFAOYSA-N`
InChI	`InChI=1S/C8H7ClO4S/c1-14(12,13)6-4-2-3-5(7(6)9)8(10)11/h2-4H,1H3,(H,10,11), InChI=1S/C9H9ClO4S/c1-5-7(15(2,13)14)4-3-6(8(5)10)9(11)12/h3-4H,1-2H3,(H,11,12)`
IUPAC name	`2-chloranyl-3-methyl-4-methylsulfonyl-benzoic acid, 2-chloranyl-3-methylsulfonyl-benzoic acid, 2-chloro-3-mesyl-benzoic acid, 2-chloro-3-methyl-4-methylsulfonyl-benzoic acid, 2-chloro-3-methyl-4-methylsulfonylbenzoic acid, 2-chloro-3-methylsulfonyl-benzoic acid, 2-chloro-3-methylsulfonylbenzoic acid, 2-chloro-4-mesyl-3-methyl-benzoic acid`
Molecular formula	`C8H7ClO4S, C9H9ClO4S`
SMILES	`CC1=C(C=CC(=C1Cl)C(=O)O)S(=O)(=O)C, CS(=O)(=O)C1=CC=CC(=C1Cl)C(=O)O`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`d150092a-7ba0-4677-8e17-0e972fd2d1b5`	2-chloro-3-methyl-4-(methylsulfonyl) benzoic acid

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	2-chloro-3-methyl-4-(methylsulfonyl) benzoic acid	Emissions/Emissions to air/Emissions to urban air close to ground	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=2-chloro-3-methyl-4-(methylsulfonyl)benzoicacid\|\|dimension=Environmental > media=Water > water_body=Unknown; cas=106904-09-0; added Common Chemistry CAS names as altLabel: 2-Chloro-3-methyl-4-(methylsulfonyl)benzoic acid, 2-Chloro-3-methyl-4-methanesulfonyl benzoic acid, 2-Chloro-3-methyl-4-methylsulfonylbenzoic acid, 2-Chloro-4-methanesulfonyl-3-methylbenzoic acid, Benzoic acid, 2-chloro-3-methyl-4-(methylsulfonyl)-; object_uuid=fo-f4a6aef12e8c0fd1
`cas_match_labels`	1	`—`	consensus_match	group_key=2-chloro-3-methyl-4-(methylsulfonyl)benzoicacid\|\|dimension=Environmental > media=Water > water_body=Unknown; group_sources=[]; cas_sources={'106904-09-0': []}; assigned CAS labels from group consensus; object_uuid=fo-f4a6aef12e8c0fd1: {'106904-09-0': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Air
strata	Ground level
population_density	Urban (>1000 people/square mile)

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`None`	[{'@value': '2-Chloro-3-methyl-4-(methylsulfonyl)benzoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:106904-09-0', 'https://commonchemistry.cas.org/detail?cas_rn=106904-09-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Chloro-3-methyl-4-methanesulfonyl benzoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:106904-09-0', 'https://commonchemistry.cas.org/detail?cas_rn=106904-09-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Chloro-3-methyl-4-methylsulfonylbenzoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:106904-09-0', 'https://commonchemistry.cas.org/detail?cas_rn=106904-09-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Chloro-4-methanesulfonyl-3-methylbenzoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:106904-09-0', 'https://commonchemistry.cas.org/detail?cas_rn=106904-09-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzoic acid, 2-chloro-3-methyl-4-(methylsulfonyl)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:106904-09-0', 'https://commonchemistry.cas.org/detail?cas_rn=106904-09-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=2-chloro-3-methyl-4-(methylsulfonyl)benzoicacid\|\|dimension=Environmental > media=Water > water_body=Unknown; cas=106904-09-0; added Common Chemistry CAS names as altLabel: 2-Chloro-3-methyl-4-(methylsulfonyl)benzoic acid, 2-Chloro-3-methyl-4-methanesulfonyl benzoic acid, 2-Chloro-3-methyl-4-methylsulfonylbenzoic acid, 2-Chloro-4-methanesulfonyl-3-methylbenzoic acid, Benzoic acid, 2-chloro-3-methyl-4-(methylsulfonyl)-; object_uuid=fo-f4a6aef12e8c0fd1
`cas_match_labels`	`None`	`{'106904-09-0': 'exactMatch'}`	group_key=2-chloro-3-methyl-4-(methylsulfonyl)benzoicacid\|\|dimension=Environmental > media=Water > water_body=Unknown; group_sources=[]; cas_sources={'106904-09-0': []}; assigned CAS labels from group consensus; object_uuid=fo-f4a6aef12e8c0fd1: {'106904-09-0': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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