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1-isocyanato-3-methylbenzene

UUID ac1b17e3-2196-4d94-b6d8-c026223a157b
Deprecated yes
Replaced By c9d2eefd-05e4-422d-8bc1-e565cc8baf78
Flow Object IDfo-dd76aefc5af8e420
Source EF 3.1
Context Environmental → Water → Unknown
CAS Numbers 621-29-4
EC Numbers 210-676-0
prefLabel
Language Value Provenance
en 1-isocyanato-3-methylbenzene
altLabel ⓘ
Language Value Provenance
en 3-Methylphenyl isocyanate
en 3-Tolyl isocyanate
en <em>m</em>-Isocyanatotoluene
en <em>m</em>-Methylphenyl isocyanate
en <em>m</em>-Tolyl isocyanate
en Benzene, 1-isocyanato-3-methyl-
en Isocyanic acid, <em>m</em>-tolyl ester
References
Shared Properties
Predicate Value
InChIKey CPPGZWWUPFWALU-UHFFFAOYSA-N, RAGWCWXAOHRROW-UHFFFAOYSA-N
InChI InChI=1S/C8H7NO/c1-7-3-2-4-8(5-7)9-6-10/h2-5H,1H3, InChI=1S/C9H9AsCl2N2O2/c11-10(12)7-3-1-6(2-4-7)9(16)14-5-8(13)15/h1-4H,5H2,(H2,13,15)(H,14,16)
IUPAC name 1-isocyanato-3-methyl-benzene, 1-isocyanato-3-methylbenzene, N-(2-amino-2-keto-ethyl)-4-dichloroarsino-benzamide, N-(2-amino-2-oxo-ethyl)-4-dichloroarsanyl-benzamide, N-(2-amino-2-oxoethyl)-4-dichloroarsanylbenzamide, N-(2-amino-2-oxoethyl)-4-dichloroarsinobenzamide, N-(2-azanyl-2-oxidanylidene-ethyl)-4-bis(chloranyl)arsanyl-benzamide
Molecular formula C8H7NO, C9H9AsCl2N2O2
SMILES C1=CC(=CC=C1C(=O)NCC(=O)N)[As](Cl)Cl, CC1=CC(=CC=C1)N=C=O

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 ac1b17e3-2196-4d94-b6d8-c026223a157b 1-isocyanato-3-methylbenzene

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-isocyanato-3-methylbenzene||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=621-29-4; added Common Chemistry CAS names as altLabel: 3-Methylphenyl isocyanate, 3-Tolyl isocyanate, <em>m</em>-Isocyanatotoluene, <em>m</em>-Methylphenyl isocyanate, <em>m</em>-Tolyl isocyanate, Benzene, 1-isocyanato-3-methyl-, Isocyanic acid, <em>m</em>-tolyl ester; object_uuid=fo-dd76aefc5af8e420
cas_match_labels 1 — consensus_match group_key=1-isocyanato-3-methylbenzene||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'621-29-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-dd76aefc5af8e420: {'621-29-4': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '3-Methylphenyl isocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:621-29-4', 'https://commonchemistry.cas.org/detail?cas_rn=621-29-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '3-Tolyl isocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:621-29-4', 'https://commonchemistry.cas.org/detail?cas_rn=621-29-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>m</em>-Isocyanatotoluene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:621-29-4', 'https://commonchemistry.cas.org/detail?cas_rn=621-29-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>m</em>-Methylphenyl isocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:621-29-4', 'https://commonchemistry.cas.org/detail?cas_rn=621-29-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>m</em>-Tolyl isocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:621-29-4', 'https://commonchemistry.cas.org/detail?cas_rn=621-29-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzene, 1-isocyanato-3-methyl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:621-29-4', 'https://commonchemistry.cas.org/detail?cas_rn=621-29-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Isocyanic acid, <em>m</em>-tolyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:621-29-4', 'https://commonchemistry.cas.org/detail?cas_rn=621-29-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=1-isocyanato-3-methylbenzene||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=621-29-4; added Common Chemistry CAS names as altLabel: 3-Methylphenyl isocyanate, 3-Tolyl isocyanate, <em>m</em>-Isocyanatotoluene, <em>m</em>-Methylphenyl isocyanate, <em>m</em>-Tolyl isocyanate, Benzene, 1-isocyanato-3-methyl-, Isocyanic acid, <em>m</em>-tolyl ester; object_uuid=fo-dd76aefc5af8e420
cas_match_labels None {'621-29-4': 'exactMatch'} group_key=1-isocyanato-3-methylbenzene||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'621-29-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-dd76aefc5af8e420: {'621-29-4': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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