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4-bromobenzaldehyde

UUID 8f2f474e-46fa-488b-9d0c-70ee622e872b
Deprecated yes
Replaced By a31ab7c1-1d14-4bf1-b234-2fc7db02ca4f
Flow Object IDfo-cb783fed9ee62386
Source EF 3.1
Context Environmental → Water → Unknown
CAS Numbers 1122-91-4
EC Numbers 214-365-0
prefLabel
Language Value Provenance
en 4-bromobenzaldehyde
altLabel ⓘ
Language Value Provenance
en 1-Bromo-4-formylbenzene
en 4-Bromobenzenealdehyde
en 4-Formyl-1-bromobenzene
en 4-Formylbromobenzene
en 4-Formylphenyl bromide
en <em>p</em>-Bromobenzaldehyde
en <em>p</em>-Formylbromobenzene
en Benzaldehyde, 4-bromo-
en Benzaldehyde, <em>p</em>-bromo-
en NSC 21638
References
Shared Properties
Predicate Value
InChIKey AQIHMSVIAGNIDM-UHFFFAOYSA-N, PXJCLNPAGNIXTJ-UHFFFAOYSA-N, SACVXUKWVLNXKI-UHFFFAOYSA-N, TUXYZHVUPGXXQG-UHFFFAOYSA-N, WYECURVXVYPVAT-UHFFFAOYSA-N, ZRYZBQLXDKPBDU-UHFFFAOYSA-N
InChI InChI=1S/C11H15N3O4S/c1-19(17,18)11-3-2-9(8-10(11)14(15)16)13-6-4-12-5-7-13/h2-3,8,12H,4-7H2,1H3, InChI=1S/C14H18O5/c1-6-3-8-14(10(18)9(6)17)12(2)4-7(16)11(19-8)13(12,14)5-15/h7-8,11,15-17H,3-5H2,1-2H3, InChI=1S/C7H5BrO/c8-7(9)6-4-2-1-3-5-6/h1-5H, InChI=1S/C7H5BrO/c8-7-3-1-6(5-9)2-4-7/h1-5H, InChI=1S/C7H5BrO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10), InChI=1S/C8H7BrO/c1-6(10)7-2-4-8(9)5-3-7/h2-5H,1H3
IUPAC name 1-(4-bromophenyl)ethanone, 1-(4-mesyl-3-nitro-phenyl)piperazine, 1-(4-methylsulfonyl-3-nitro-phenyl)piperazine, 1-(4-methylsulfonyl-3-nitrophenyl)piperazine, 2-(hydroxymethyl)-3,10-dimethyl-5,11-bis(oxidanyl)-7-oxatetracyclo[6.4.0.01,3.02,6]dodec-10-en-12-one, 4-bromanylbenzaldehyde, 4-bromanylbenzoic acid, 4-bromobenzaldehyde, 4-bromobenzoic acid, 5,11-dihydroxy-2-(hydroxymethyl)-3,10-dimethyl-7-oxatetracyclo[6.4.0.01,3.02,6]dodec-10-en-12-one, 5,11-dihydroxy-3,10-dimethyl-2-methylol-7-oxatetracyclo[6.4.0.01,3.02,6]dodec-10-en-12-one, benzoyl bromide
Molecular formula C11H15N3O4S, C14H18O5, C7H5BrO, C7H5BrO2, C8H7BrO
SMILES C1=CC(=CC=C1C(=O)O)Br, C1=CC(=CC=C1C=O)Br, C1=CC=C(C=C1)C(=O)Br, CC(=O)C1=CC=C(C=C1)Br, CC1=C(C(=O)C23C(C1)OC4C2(C3(CC4O)C)CO)O, CS(=O)(=O)C1=C(C=C(C=C1)N2CCNCC2)[N+](=O)[O-]

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 8f2f474e-46fa-488b-9d0c-70ee622e872b 4-bromobenzaldehyde

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-bromobenzaldehyde||dimension=Environmental > media=Water > water_body=Surface water; cas=1122-91-4; added Common Chemistry CAS names as altLabel: 1-Bromo-4-formylbenzene, 4-Bromobenzenealdehyde, 4-Formyl-1-bromobenzene, 4-Formylbromobenzene, 4-Formylphenyl bromide, <em>p</em>-Bromobenzaldehyde, <em>p</em>-Formylbromobenzene, Benzaldehyde, 4-bromo-, Benzaldehyde, <em>p</em>-bromo-, NSC 21638; object_uuid=fo-cb783fed9ee62386
cas_match_labels 1 — consensus_match group_key=4-bromobenzaldehyde||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'1122-91-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-cb783fed9ee62386: {'1122-91-4': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '1-Bromo-4-formylbenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1122-91-4', 'https://commonchemistry.cas.org/detail?cas_rn=1122-91-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '4-Bromobenzenealdehyde', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1122-91-4', 'https://commonchemistry.cas.org/detail?cas_rn=1122-91-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '4-Formyl-1-bromobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1122-91-4', 'https://commonchemistry.cas.org/detail?cas_rn=1122-91-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '4-Formylbromobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1122-91-4', 'https://commonchemistry.cas.org/detail?cas_rn=1122-91-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '4-Formylphenyl bromide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1122-91-4', 'https://commonchemistry.cas.org/detail?cas_rn=1122-91-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>p</em>-Bromobenzaldehyde', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1122-91-4', 'https://commonchemistry.cas.org/detail?cas_rn=1122-91-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>p</em>-Formylbromobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1122-91-4', 'https://commonchemistry.cas.org/detail?cas_rn=1122-91-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzaldehyde, 4-bromo-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1122-91-4', 'https://commonchemistry.cas.org/detail?cas_rn=1122-91-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzaldehyde, <em>p</em>-bromo-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1122-91-4', 'https://commonchemistry.cas.org/detail?cas_rn=1122-91-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 21638', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1122-91-4', 'https://commonchemistry.cas.org/detail?cas_rn=1122-91-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=4-bromobenzaldehyde||dimension=Environmental > media=Water > water_body=Surface water; cas=1122-91-4; added Common Chemistry CAS names as altLabel: 1-Bromo-4-formylbenzene, 4-Bromobenzenealdehyde, 4-Formyl-1-bromobenzene, 4-Formylbromobenzene, 4-Formylphenyl bromide, <em>p</em>-Bromobenzaldehyde, <em>p</em>-Formylbromobenzene, Benzaldehyde, 4-bromo-, Benzaldehyde, <em>p</em>-bromo-, NSC 21638; object_uuid=fo-cb783fed9ee62386
cas_match_labels None {'1122-91-4': 'exactMatch'} group_key=4-bromobenzaldehyde||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'1122-91-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-cb783fed9ee62386: {'1122-91-4': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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        "2-(hydroxymethyl)-3,10-dimethyl-5,11-bis(oxidanyl)-7-oxatetracyclo[6.4.0.01,3.02,6]dodec-10-en-12-one",
        "4-bromanylbenzaldehyde",
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