4-bromophenyl Acetate

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UUID 2cbeedff-bce5-4fa3-a718-60e644aea769

Flow Object ID fo-6193ab20b01f5e19

Source EF 3.1

Context Environmental → Water → Surface water

CAS Numbers 1927-95-3

EC Numbers 217-668-6

prefLabel

Language	Value	Provenance
`en`	`4-bromophenyl Acetate`

altLabel ⓘ

Language	Value	Provenance
`en`	`1-Acetoxy-4-bromobenzene`
`en`	`1-Bromo-4-acetoxybenzene`
`en`	`4-Acetoxybromobenzene`
`en`	`4-Bromoacetoxybenzene`
`en`	`4-Bromophenol acetate`
`en`	`<em>p</em>-Acetoxybromobenzene`
`en`	`<em>p</em>-Bromophenyl acetate`
`en`	`NSC 404083`
`en`	`Phenol, 4-bromo-, 1-acetate`
`en`	`Phenol, 4-bromo-, acetate`
`en`	`Phenol, <em>p</em>-bromo-, acetate`

References

Shared Properties

Predicate	Value
InChIKey	`BCUBFQJBIVOSFG-QXRAWODBSA-N, HRZAEVRVELIZBO-UHFFFAOYSA-N, PGIMYCDHCCUGLC-UHFFFAOYSA-N, QOWSWEBLNVACCL-UHFFFAOYSA-N, XEXHCQJRVMVJMY-UHFFFAOYSA-N`
InChI	`InChI=1S/C16H28O5/c1-14(2)10-12-7-5-6-11(8-9-17)16(12)13(18-4)19-15(14,3)20-21-16/h11-13,17H,5-10H2,1-4H3/t11-,12+,13-,15-,16?/m0/s1, InChI=1S/C6H5BrO.C2H4O2/c7-5-1-3-6(8)4-2-5;1-2(3)4/h1-4,8H;1H3,(H,3,4), InChI=1S/C7H7BrFN.ClH/c1-10-7-3-2-5(8)4-6(7)9;/h2-4,10H,1H3;1H, InChI=1S/C8H7BrO2/c1-6(10)11-8-4-2-7(9)3-5-8/h2-5H,1H3, InChI=1S/C8H7BrO2/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4H,5H2,(H,10,11)`
IUPAC name	(4-bromo-2-fluoro-phenyl)-methyl-amine;hydrochloride, (4-bromophenyl) acetate, (4-bromophenyl) ethanoate, 2-(4-bromophenyl)acetic acid, 2-(4-bromophenyl)ethanoic acid, 2-[(2S,6R,9S,12S)-12-methoxy-8,8,9-trimethyl-10,11,13-trioxatricyclo[7.2.2.01,6]tridecan-2-yl]ethanol, 4-bromanyl-2-fluoranyl-N-methyl-aniline;hydrochloride, 4-bromanylphenol;ethanoic acid, 4-bromo-2-fluoro-N-methyl-aniline;hydrochloride, 4-bromo-2-fluoro-N-methylaniline;hydrochloride, acetic acid (4-bromophenyl) ester, acetic acid;4-bromophenol
Molecular formula	`C16H28O5, C7H8BrClFN, C8H7BrO2, C8H9BrO3`
SMILES	`C1=CC(=CC=C1CC(=O)O)Br, CC(=O)O.C1=CC(=CC=C1O)Br, CC(=O)OC1=CC=C(C=C1)Br, CC1(CC2CCCC(C23C(OC1(OO3)C)OC)CCO)C, CNC1=C(C=C(C=C1)Br)F.Cl, C[C@]12C(C[C@H]3CCC[C@H](C3([C@H](O1)OC)OO2)CCO)(C)C`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`2cbeedff-bce5-4fa3-a718-60e644aea769`	4-bromophenyl acetate

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	4-bromophenyl acetate	Emissions/Emissions to water/Emissions to fresh water	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-bromophenylacetate\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=1927-95-3; added Common Chemistry CAS names as altLabel: 1-Acetoxy-4-bromobenzene, 1-Bromo-4-acetoxybenzene, 4-Acetoxybromobenzene, 4-Bromoacetoxybenzene, 4-Bromophenol acetate, <em>p</em>-Acetoxybromobenzene, <em>p</em>-Bromophenyl acetate, NSC 404083, Phenol, 4-bromo-, 1-acetate, Phenol, 4-bromo-, acetate, Phenol, <em>p</em>-bromo-, acetate; object_uuid=fo-6193ab20b01f5e19
`cas_match_labels`	1	`—`	consensus_match	group_key=4-bromophenylacetate\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'1927-95-3': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6193ab20b01f5e19: {'1927-95-3': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Water
water_body	Surface water

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`None`	[{'@value': '1-Acetoxy-4-bromobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1927-95-3', 'https://commonchemistry.cas.org/detail?cas_rn=1927-95-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1-Bromo-4-acetoxybenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1927-95-3', 'https://commonchemistry.cas.org/detail?cas_rn=1927-95-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '4-Acetoxybromobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1927-95-3', 'https://commonchemistry.cas.org/detail?cas_rn=1927-95-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '4-Bromoacetoxybenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1927-95-3', 'https://commonchemistry.cas.org/detail?cas_rn=1927-95-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '4-Bromophenol acetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1927-95-3', 'https://commonchemistry.cas.org/detail?cas_rn=1927-95-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>p</em>-Acetoxybromobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1927-95-3', 'https://commonchemistry.cas.org/detail?cas_rn=1927-95-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>p</em>-Bromophenyl acetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1927-95-3', 'https://commonchemistry.cas.org/detail?cas_rn=1927-95-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 404083', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1927-95-3', 'https://commonchemistry.cas.org/detail?cas_rn=1927-95-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Phenol, 4-bromo-, 1-acetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1927-95-3', 'https://commonchemistry.cas.org/detail?cas_rn=1927-95-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Phenol, 4-bromo-, acetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1927-95-3', 'https://commonchemistry.cas.org/detail?cas_rn=1927-95-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Phenol, <em>p</em>-bromo-, acetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1927-95-3', 'https://commonchemistry.cas.org/detail?cas_rn=1927-95-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=4-bromophenylacetate\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=1927-95-3; added Common Chemistry CAS names as altLabel: 1-Acetoxy-4-bromobenzene, 1-Bromo-4-acetoxybenzene, 4-Acetoxybromobenzene, 4-Bromoacetoxybenzene, 4-Bromophenol acetate, <em>p</em>-Acetoxybromobenzene, <em>p</em>-Bromophenyl acetate, NSC 404083, Phenol, 4-bromo-, 1-acetate, Phenol, 4-bromo-, acetate, Phenol, <em>p</em>-bromo-, acetate; object_uuid=fo-6193ab20b01f5e19
`cas_match_labels`	`None`	`{'1927-95-3': 'exactMatch'}`	group_key=4-bromophenylacetate\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'1927-95-3': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6193ab20b01f5e19: {'1927-95-3': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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