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1,3-bis(1-isocyanato-1-methylethyl)benzene

UUID 8fa9436c-8320-46a4-ad12-486e68a987b7
Flow Object IDfo-648c71bc7e4bd041
Source EF 3.1
Context Environmental → Air → Ground level → Urban (>1000 people/square mile)
CAS Numbers 2778-42-9
EC Numbers 220-474-4
prefLabel
Language Value Provenance
en 1,3-bis(1-isocyanato-1-methylethyl)benzene
altLabel ⓘ
Language Value Provenance
en 1,3-Bis(1-isocyanatolmethylethyl)benzene
en 1,3-Bis(1-methyl-1-isocyanatoethyl)benzene
en 1,3-Bis(2-isocyanato-prop-2-yl)benzene
en 1,3-Bis(2-isocyanatopropan-2-yl)benzene
en 1,3-Bis(α-isocyanatoisopropyl)benzene
en <em>m</em>-Bis(1-isocyanato-1-methylethyl)benzene
en <em>m</em>-TMXDI
en <em>m</em>-Tetramethylxylene diisocyanate
en Benzene, 1,3-bis(1-isocyanato-1-methylethyl)-
en Isocyanic acid, <em>m</em>-phenylenediisopropylidene ester
en Isocyanic acid, α,α,α′,α′-tetramethyl-<em>m</em>-xylylene ester
en Meta-tetramethylxylylene diisocyanate
en Tetramethyl-1,3-xylylene diisocyanate
en Tetramethyl-<em>m</em>-xylylene diisocyanate
en α,α,α′,α′-Tetramethyl-1,3-xylene diisocyanate
en α,α,α′,α′-Tetramethyl-1,3-xylylen diisocyanate
en α,α,α′,α′-Tetramethyl-1,3-xylylene diisocyanate
en α,α,α′,α′-Tetramethyl-<em>m</em>-phenylenedimethylene diisocyanate
en α,α,α′,α′-Tetramethyl-<em>m</em>-xylene diisocyanate
en α,α,α′,α′-Tetramethyl-<em>m</em>-xylylene diisocyanate
References
Shared Properties
Predicate Value
InChIKey AZYRZNIYJDKRHO-UHFFFAOYSA-N
InChI InChI=1S/C14H16N2O2/c1-13(2,15-9-17)11-6-5-7-12(8-11)14(3,4)16-10-18/h5-8H,1-4H3
IUPAC name 1,3-bis(1-isocyanato-1-methyl-ethyl)benzene, 1,3-bis(2-isocyanatopropan-2-yl)benzene
Molecular formula C14H16N2O2
SMILES CC(C)(C1=CC(=CC=C1)C(C)(C)N=C=O)N=C=O

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 8fa9436c-8320-46a4-ad12-486e68a987b7 1,3-bis(1-isocyanato-1-methylethyl)benzene

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 1,3-bis(1-isocyanato-1-methylethyl)benzene Emissions/Emissions to air/Emissions to urban air close to ground 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=1,3-bis(1-isocyanato-1-methylethyl)benzene||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=2778-42-9; added Common Chemistry CAS names as altLabel: 1,3-Bis(1-isocyanatolmethylethyl)benzene, 1,3-Bis(1-methyl-1-isocyanatoethyl)benzene, 1,3-Bis(2-isocyanato-prop-2-yl)benzene, 1,3-Bis(2-isocyanatopropan-2-yl)benzene, 1,3-Bis(α-isocyanatoisopropyl)benzene, <em>m</em>-Bis(1-isocyanato-1-methylethyl)benzene, <em>m</em>-TMXDI, <em>m</em>-Tetramethylxylene diisocyanate, Benzene, 1,3-bis(1-isocyanato-1-methylethyl)-, Isocyanic acid, <em>m</em>-phenylenediisopropylidene ester, Isocyanic acid, α,α,α′,α′-tetramethyl-<em>m</em>-xylylene ester, Meta-tetramethylxylylene diisocyanate, Tetramethyl-1,3-xylylene diisocyanate, Tetramethyl-<em>m</em>-xylylene diisocyanate, α,α,α′,α′-Tetramethyl-1,3-xylene diisocyanate, α,α,α′,α′-Tetramethyl-1,3-xylylen diisocyanate, α,α,α′,α′-Tetramethyl-1,3-xylylene diisocyanate, α,α,α′,α′-Tetramethyl-<em>m</em>-phenylenedimethylene diisocyanate, α,α,α′,α′-Tetramethyl-<em>m</em>-xylene diisocyanate, α,α,α′,α′-Tetramethyl-<em>m</em>-xylylene diisocyanate; object_uuid=fo-648c71bc7e4bd041
cas_match_labels 1 — consensus_match group_key=1,3-bis(1-isocyanato-1-methylethyl)benzene||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['ec_inventory', 'pubchem']; cas_sources={'2778-42-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-648c71bc7e4bd041: {'2778-42-9': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaAir
strataGround level
population_densityUrban (>1000 people/square mile)

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '1,3-Bis(1-isocyanatolmethylethyl)benzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2778-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=2778-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,3-Bis(1-methyl-1-isocyanatoethyl)benzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2778-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=2778-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,3-Bis(2-isocyanato-prop-2-yl)benzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2778-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=2778-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,3-Bis(2-isocyanatopropan-2-yl)benzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2778-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=2778-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,3-Bis(α-isocyanatoisopropyl)benzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2778-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=2778-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>m</em>-Bis(1-isocyanato-1-methylethyl)benzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2778-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=2778-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>m</em>-TMXDI', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2778-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=2778-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>m</em>-Tetramethylxylene diisocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2778-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=2778-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzene, 1,3-bis(1-isocyanato-1-methylethyl)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2778-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=2778-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Isocyanic acid, <em>m</em>-phenylenediisopropylidene ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2778-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=2778-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Isocyanic acid, α,α,α′,α′-tetramethyl-<em>m</em>-xylylene ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2778-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=2778-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Meta-tetramethylxylylene diisocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2778-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=2778-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Tetramethyl-1,3-xylylene diisocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2778-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=2778-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Tetramethyl-<em>m</em>-xylylene diisocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2778-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=2778-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'α,α,α′,α′-Tetramethyl-1,3-xylene diisocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2778-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=2778-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'α,α,α′,α′-Tetramethyl-1,3-xylylen diisocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2778-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=2778-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'α,α,α′,α′-Tetramethyl-1,3-xylylene diisocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2778-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=2778-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'α,α,α′,α′-Tetramethyl-<em>m</em>-phenylenedimethylene diisocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2778-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=2778-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'α,α,α′,α′-Tetramethyl-<em>m</em>-xylene diisocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2778-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=2778-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'α,α,α′,α′-Tetramethyl-<em>m</em>-xylylene diisocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2778-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=2778-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=1,3-bis(1-isocyanato-1-methylethyl)benzene||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=2778-42-9; added Common Chemistry CAS names as altLabel: 1,3-Bis(1-isocyanatolmethylethyl)benzene, 1,3-Bis(1-methyl-1-isocyanatoethyl)benzene, 1,3-Bis(2-isocyanato-prop-2-yl)benzene, 1,3-Bis(2-isocyanatopropan-2-yl)benzene, 1,3-Bis(α-isocyanatoisopropyl)benzene, <em>m</em>-Bis(1-isocyanato-1-methylethyl)benzene, <em>m</em>-TMXDI, <em>m</em>-Tetramethylxylene diisocyanate, Benzene, 1,3-bis(1-isocyanato-1-methylethyl)-, Isocyanic acid, <em>m</em>-phenylenediisopropylidene ester, Isocyanic acid, α,α,α′,α′-tetramethyl-<em>m</em>-xylylene ester, Meta-tetramethylxylylene diisocyanate, Tetramethyl-1,3-xylylene diisocyanate, Tetramethyl-<em>m</em>-xylylene diisocyanate, α,α,α′,α′-Tetramethyl-1,3-xylene diisocyanate, α,α,α′,α′-Tetramethyl-1,3-xylylen diisocyanate, α,α,α′,α′-Tetramethyl-1,3-xylylene diisocyanate, α,α,α′,α′-Tetramethyl-<em>m</em>-phenylenedimethylene diisocyanate, α,α,α′,α′-Tetramethyl-<em>m</em>-xylene diisocyanate, α,α,α′,α′-Tetramethyl-<em>m</em>-xylylene diisocyanate; object_uuid=fo-648c71bc7e4bd041
cas_match_labels None {'2778-42-9': 'exactMatch'} group_key=1,3-bis(1-isocyanato-1-methylethyl)benzene||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['ec_inventory', 'pubchem']; cas_sources={'2778-42-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-648c71bc7e4bd041: {'2778-42-9': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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    "population_density": "Urban (>1000 people/square mile)"
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