4-bromobenzyl Alcohol

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UUID 20c0efbd-e412-44e5-9dfd-3be793e253a0

Flow Object ID fo-533b4b6e84b32e42

Source EF 3.1

Context Environmental → Air → High stack, >150 meters

CAS Numbers 873-75-6

EC Numbers 212-851-7

prefLabel

Language	Value	Provenance
`en`	`4-bromobenzyl Alcohol`

altLabel ⓘ

Language	Value	Provenance
`en`	`(4-Bromophenyl)methanol`
`en`	`(<em>p</em>-Bromophenyl)methanol`
`en`	`1-(<em>p</em>-Bromophenyl)methanol`
`en`	`1-Bromo-4-(hydroxymethyl)benzene`
`en`	`4-Bromobenzenemethanol`
`en`	`4-Hydroxymethyl-1-bromobenzene`
`en`	`<em>p</em>-Bromobenzyl alcohol`
`en`	`Benzenemethanol, 4-bromo-`
`en`	`Benzyl alcohol, <em>p</em>-bromo-`

References

Shared Properties

Predicate	Value
InChIKey	`KLSAAUGREIROIS-RQXIQXTJSA-N, LONVZHSFEFHYQY-UHFFFAOYSA-N, TUXYZHVUPGXXQG-UHFFFAOYSA-N, VEDDBHYQWFOITD-UHFFFAOYSA-N`
InChI	`InChI=1S/C12H14FNO3/c1-16-12(15)10-8-9(13)2-3-11(10)14-4-6-17-7-5-14/h2-3,8H,4-7H2,1H3, InChI=1S/C7H5BrO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10), InChI=1S/C7H7BrO/c8-7-3-1-6(5-9)2-4-7/h1-4,9H,5H2, InChI=1S/C9H14O8/c1-9(8(13)14)16-5-3(2-10)15-7(12)4(11)6(5)17-9/h3-7,10-12H,2H2,1H3,(H,13,14)/t3-,4-,5+,6-,7-,9-/m1/s1`
IUPAC name	(2S,3aS,4R,6R,7R,7aR)-4-(hydroxymethyl)-2-methyl-6,7-bis(oxidanyl)-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-2-carboxylic acid, (2S,3aS,4R,6R,7R,7aR)-6,7-dihydroxy-2-methyl-4-methylol-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-2-carboxylic acid, (2S,3aS,4R,6R,7R,7aR)-6,7-dihydroxy-4-(hydroxymethyl)-2-methyl-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-2-carboxylic acid, (4-bromophenyl)methanol, 4-bromanylbenzoic acid, 4-bromobenzoic acid, 5-fluoro-2-(4-morpholinyl)benzoic acid methyl ester, 5-fluoro-2-morpholino-benzoic acid methyl ester, methyl 5-fluoranyl-2-morpholin-4-yl-benzoate, methyl 5-fluoro-2-morpholin-4-ylbenzoate, methyl 5-fluoro-2-morpholino-benzoate
Molecular formula	`C12H14FNO3, C7H5BrO2, C7H7BrO, C9H14O8`
SMILES	`C1=CC(=CC=C1C(=O)O)Br, C1=CC(=CC=C1CO)Br, CC1(OC2C(OC(C(C2O1)O)O)CO)C(=O)O, COC(=O)C1=C(C=CC(=C1)F)N2CCOCC2, C[C@]1(O[C@H]2[C@H](O[C@H]([C@@H]([C@H]2O1)O)O)CO)C(=O)O`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`20c0efbd-e412-44e5-9dfd-3be793e253a0`	4-bromobenzyl alcohol

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	4-bromobenzyl alcohol	Emissions/Emissions to air/Emissions to non-urban air or from high stacks	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-bromobenzylalcohol\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=873-75-6; added Common Chemistry CAS names as altLabel: (4-Bromophenyl)methanol, (<em>p</em>-Bromophenyl)methanol, 1-(<em>p</em>-Bromophenyl)methanol, 1-Bromo-4-(hydroxymethyl)benzene, 4-Bromobenzenemethanol, 4-Hydroxymethyl-1-bromobenzene, <em>p</em>-Bromobenzyl alcohol, Benzenemethanol, 4-bromo-, Benzyl alcohol, <em>p</em>-bromo-; object_uuid=fo-533b4b6e84b32e42
`cas_match_labels`	1	`—`	consensus_match	group_key=4-bromobenzylalcohol\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'873-75-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-533b4b6e84b32e42: {'873-75-6': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Air
strata	High stack, >150 meters

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`None`	[{'@value': '(4-Bromophenyl)methanol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:873-75-6', 'https://commonchemistry.cas.org/detail?cas_rn=873-75-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '(<em>p</em>-Bromophenyl)methanol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:873-75-6', 'https://commonchemistry.cas.org/detail?cas_rn=873-75-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1-(<em>p</em>-Bromophenyl)methanol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:873-75-6', 'https://commonchemistry.cas.org/detail?cas_rn=873-75-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1-Bromo-4-(hydroxymethyl)benzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:873-75-6', 'https://commonchemistry.cas.org/detail?cas_rn=873-75-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '4-Bromobenzenemethanol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:873-75-6', 'https://commonchemistry.cas.org/detail?cas_rn=873-75-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '4-Hydroxymethyl-1-bromobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:873-75-6', 'https://commonchemistry.cas.org/detail?cas_rn=873-75-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>p</em>-Bromobenzyl alcohol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:873-75-6', 'https://commonchemistry.cas.org/detail?cas_rn=873-75-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzenemethanol, 4-bromo-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:873-75-6', 'https://commonchemistry.cas.org/detail?cas_rn=873-75-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzyl alcohol, <em>p</em>-bromo-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:873-75-6', 'https://commonchemistry.cas.org/detail?cas_rn=873-75-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=4-bromobenzylalcohol\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=873-75-6; added Common Chemistry CAS names as altLabel: (4-Bromophenyl)methanol, (<em>p</em>-Bromophenyl)methanol, 1-(<em>p</em>-Bromophenyl)methanol, 1-Bromo-4-(hydroxymethyl)benzene, 4-Bromobenzenemethanol, 4-Hydroxymethyl-1-bromobenzene, <em>p</em>-Bromobenzyl alcohol, Benzenemethanol, 4-bromo-, Benzyl alcohol, <em>p</em>-bromo-; object_uuid=fo-533b4b6e84b32e42
`cas_match_labels`	`None`	`{'873-75-6': 'exactMatch'}`	group_key=4-bromobenzylalcohol\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'873-75-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-533b4b6e84b32e42: {'873-75-6': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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        "(2S,3aS,4R,6R,7R,7aR)-6,7-dihydroxy-2-methyl-4-methylol-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-2-carboxylic acid",
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