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1,3-bis(isocyanatomethyl)benzene

UUID b1303105-f995-43e4-b116-43b7e7987c18
Flow Object IDfo-d7bfa6660a8bf413
Source EF 3.1
Context Environmental → Water → Ocean
CAS Numbers 3634-83-1
EC Numbers 222-852-4
prefLabel
Language Value Provenance
en 1,3-bis(isocyanatomethyl)benzene
altLabel ⓘ
Language Value Provenance
en (Benzene-1,3-diyl)dimethyl diisocyanate
en 1,3-Di(isocyanatomethyl)benzene
en 1,3-Xylene diisocyanate
en 1,3-Xylylene diisocyanate
en <em>m</em>-Phenylenedimethylene isocyanate
en <em>m</em>-Xylylene diisocyanate
en Benzene, 1,3-bis(isocyanatomethyl)-
en Isocyanic acid, <em>m</em>-phenylenedimethylene ester
en m-XDI
en ω,ω′-Diisocyanato-1,3-dimethylbenzene
References
Shared Properties
Predicate Value
InChIKey FTFMKRHYDDCRSA-UHFFFAOYSA-N, RTTZISZSHSCFRH-UHFFFAOYSA-N, ZORJABCBMIYHSQ-UHFFFAOYSA-N
InChI InChI=1S/C10H8N2O2/c1-8-3-2-4-9(5-8)10(11-6-13)12-7-14/h2-5,10H,1H3, InChI=1S/C10H8N2O2/c13-7-11-5-9-2-1-3-10(4-9)6-12-8-14/h1-4H,5-6H2, InChI=1S/C8H8N2O2/c11-9-5-7-2-1-3-8(4-7)6-10-12/h1-4H,5-6H2
IUPAC name 1,3-bis(isocyanatomethyl)benzene, 1,3-bis(nitrosomethyl)benzene, 1-(diisocyanatomethyl)-3-methyl-benzene, 1-(diisocyanatomethyl)-3-methylbenzene
Molecular formula C10H8N2O2, C8H8N2O2
SMILES C1=CC(=CC(=C1)CN=C=O)CN=C=O, C1=CC(=CC(=C1)CN=O)CN=O, CC1=CC(=CC=C1)C(N=C=O)N=C=O

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 b1303105-f995-43e4-b116-43b7e7987c18 1,3-bis(isocyanatomethyl)benzene

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 1,3-bis(isocyanatomethyl)benzene Emissions/Emissions to water/Emissions to sea water 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(isocyanatomethyl)benzene||dimension=Environmental > media=Water > water_body=Surface water; cas=3634-83-1; added Common Chemistry CAS names as altLabel: (Benzene-1,3-diyl)dimethyl diisocyanate, 1,3-Di(isocyanatomethyl)benzene, 1,3-Xylene diisocyanate, 1,3-Xylylene diisocyanate, <em>m</em>-Phenylenedimethylene isocyanate, <em>m</em>-Xylylene diisocyanate, Benzene, 1,3-bis(isocyanatomethyl)-, Isocyanic acid, <em>m</em>-phenylenedimethylene ester, m-XDI, ω,ω′-Diisocyanato-1,3-dimethylbenzene; object_uuid=fo-d7bfa6660a8bf413
cas_match_labels 1 — consensus_match group_key=1,3-bis(isocyanatomethyl)benzene||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory']; cas_sources={'3634-83-1': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-d7bfa6660a8bf413: {'3634-83-1': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyOcean

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '(Benzene-1,3-diyl)dimethyl diisocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:3634-83-1', 'https://commonchemistry.cas.org/detail?cas_rn=3634-83-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,3-Di(isocyanatomethyl)benzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:3634-83-1', 'https://commonchemistry.cas.org/detail?cas_rn=3634-83-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,3-Xylene diisocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:3634-83-1', 'https://commonchemistry.cas.org/detail?cas_rn=3634-83-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,3-Xylylene diisocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:3634-83-1', 'https://commonchemistry.cas.org/detail?cas_rn=3634-83-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>m</em>-Phenylenedimethylene isocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:3634-83-1', 'https://commonchemistry.cas.org/detail?cas_rn=3634-83-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>m</em>-Xylylene diisocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:3634-83-1', 'https://commonchemistry.cas.org/detail?cas_rn=3634-83-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzene, 1,3-bis(isocyanatomethyl)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:3634-83-1', 'https://commonchemistry.cas.org/detail?cas_rn=3634-83-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Isocyanic acid, <em>m</em>-phenylenedimethylene ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:3634-83-1', 'https://commonchemistry.cas.org/detail?cas_rn=3634-83-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'm-XDI', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:3634-83-1', 'https://commonchemistry.cas.org/detail?cas_rn=3634-83-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'ω,ω′-Diisocyanato-1,3-dimethylbenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:3634-83-1', 'https://commonchemistry.cas.org/detail?cas_rn=3634-83-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=1,3-bis(isocyanatomethyl)benzene||dimension=Environmental > media=Water > water_body=Surface water; cas=3634-83-1; added Common Chemistry CAS names as altLabel: (Benzene-1,3-diyl)dimethyl diisocyanate, 1,3-Di(isocyanatomethyl)benzene, 1,3-Xylene diisocyanate, 1,3-Xylylene diisocyanate, <em>m</em>-Phenylenedimethylene isocyanate, <em>m</em>-Xylylene diisocyanate, Benzene, 1,3-bis(isocyanatomethyl)-, Isocyanic acid, <em>m</em>-phenylenedimethylene ester, m-XDI, ω,ω′-Diisocyanato-1,3-dimethylbenzene; object_uuid=fo-d7bfa6660a8bf413
cas_match_labels None {'3634-83-1': 'exactMatch'} group_key=1,3-bis(isocyanatomethyl)benzene||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory']; cas_sources={'3634-83-1': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-d7bfa6660a8bf413: {'3634-83-1': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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