1,4-dimethoxy-2-nitrobenzene

← Back to consensus flows

1,4-dimethoxy-2-nitrobenzene

UUID ee9b0643-d4e8-4239-997f-ece755d36496

Deprecated yes

Replaced By 02d77e9a-470a-409b-9889-10d5f30ebda8

Flow Object ID fo-689aaded2c34fa8c

Source EF 3.1

Context Environmental → Water → Unknown

CAS Numbers 89-39-4

EC Numbers 201-903-4

prefLabel

Language	Value	Provenance
`en`	`1,4-dimethoxy-2-nitrobenzene`

altLabel ⓘ

Language	Value	Provenance
`en`	`2,5-Dimethoxynitrobenzene`
`en`	`Benzene, 1,4-dimethoxy-2-nitro-`
`en`	`NSC 1321`
`en`	`NSC 37986`
`en`	`Nitrohydroquinone dimethyl ether`

References

Shared Properties

Predicate	Value
InChIKey	`QBFLFADAZIZAOH-UHFFFAOYSA-N, UPTOWXNJLZJTGD-UHFFFAOYSA-N`
InChI	`InChI=1S/C16H15NO4/c1-17-12-8-9-13(16(19)20-2)14(10-12)21-15(18)11-6-4-3-5-7-11/h3-10,17H,1-2H3, InChI=1S/C8H9NO4/c1-12-6-3-4-8(13-2)7(5-6)9(10)11/h3-5H,1-2H3`
IUPAC name	`1,4-dimethoxy-2-nitro-benzene, 1,4-dimethoxy-2-nitrobenzene, 2-benzoyloxy-4-(methylamino)benzoic acid methyl ester, methyl 2-benzoyloxy-4-(methylamino)benzoate, methyl 4-(methylamino)-2-(phenylcarbonyloxy)benzoate`
Molecular formula	`C16H15NO4, C8H9NO4`
SMILES	`CNC1=CC(=C(C=C1)C(=O)OC)OC(=O)C2=CC=CC=C2, COC1=CC(=C(C=C1)OC)[N+](=O)[O-]`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`ee9b0643-d4e8-4239-997f-ece755d36496`	1,4-dimethoxy-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=1,4-dimethoxy-2-nitrobenzene\|\|dimension=Environmental > media=Water > water_body=Unknown; cas=89-39-4; added Common Chemistry CAS names as altLabel: 2,5-Dimethoxynitrobenzene, Benzene, 1,4-dimethoxy-2-nitro-, NSC 1321, NSC 37986, Nitrohydroquinone dimethyl ether; object_uuid=fo-689aaded2c34fa8c
`cas_match_labels`	1	`—`	consensus_match	group_key=1,4-dimethoxy-2-nitrobenzene\|\|dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'89-39-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-689aaded2c34fa8c: {'89-39-4': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Water
water_body	Unknown

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`None`	[{'@value': '2,5-Dimethoxynitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:89-39-4', 'https://commonchemistry.cas.org/detail?cas_rn=89-39-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzene, 1,4-dimethoxy-2-nitro-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:89-39-4', 'https://commonchemistry.cas.org/detail?cas_rn=89-39-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 1321', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:89-39-4', 'https://commonchemistry.cas.org/detail?cas_rn=89-39-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 37986', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:89-39-4', 'https://commonchemistry.cas.org/detail?cas_rn=89-39-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Nitrohydroquinone dimethyl ether', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:89-39-4', 'https://commonchemistry.cas.org/detail?cas_rn=89-39-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=1,4-dimethoxy-2-nitrobenzene\|\|dimension=Environmental > media=Water > water_body=Unknown; cas=89-39-4; added Common Chemistry CAS names as altLabel: 2,5-Dimethoxynitrobenzene, Benzene, 1,4-dimethoxy-2-nitro-, NSC 1321, NSC 37986, Nitrohydroquinone dimethyl ether; object_uuid=fo-689aaded2c34fa8c
`cas_match_labels`	`None`	`{'89-39-4': 'exactMatch'}`	group_key=1,4-dimethoxy-2-nitrobenzene\|\|dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'89-39-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-689aaded2c34fa8c: {'89-39-4': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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