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N,n'-[6-(5-nitro-2-furyl)-s-triazine-2,4-diyl]bisacetamide

2D structure
Flow Object IDfo-bd091420f9a50a5b
TypeConsensus
prefLabel
Label Language
N,n'-[6-(5-nitro-2-furyl)-s-triazine-2,4-diyl]bisacetamide en
CAS Numbers 51325-35-0
Changes Applied13

Provenance

Field Value
Resolverhybrid_name_cas_v1
Seed SourceEF 3.1
Seed Flow3e4d5089-6556-11dd-ad8b-0800200c9a66

Properties

Predicate Value
InChIKey OSFMMSIDSIQFIT-UHFFFAOYSA-N
InChI InChI=1S/C11H10N6O5/c1-5(18)12-10-14-9(15-11(16-10)13-6(2)19)7-3-4-8(22-7)17(20)21/h3-4H,1-2H3,(H2,12,13,14,15,16,18,19)
IUPAC name N-[4-acetamido-6-(5-nitro-2-furanyl)-1,3,5-triazin-2-yl]acetamide, N-[4-acetamido-6-(5-nitro-2-furyl)-1,3,5-triazin-2-yl]acetamide, N-[4-acetamido-6-(5-nitro-2-furyl)-s-triazin-2-yl]acetamide, N-[4-acetamido-6-(5-nitrofuran-2-yl)-1,3,5-triazin-2-yl]acetamide, N-[4-acetamido-6-(5-nitrofuran-2-yl)-1,3,5-triazin-2-yl]ethanamide
Molecular formula C11H10N6O5
Molecular mass 306.238
Monoisotopic mass 306.071267
SMILES CC(=O)NC1=NC(=NC(=N1)C2=CC=C(O2)[N+](=O)[O-])NC(=O)C, CC(=O)Nc1nc(NC(C)=O)nc(-c2ccc([N+](=O)[O-])o2)n1

References

Linked Elementary Flows

UUID Source Unit Context LCIA Factors Consensus Changes
3e4d5089… EF 3.1 kg Environmental → Air → Aircraft cruise height 2 1
fe0acd60… EF 3.1 kg Environmental → Air → Ground level → Rural (<1000 people/square mile) 0 1
fe0acd60… EF 3.1 kg Environmental → Air → Ground level → Urban (>1000 people/square mile) 2 1
fe0acd60… EF 3.1 kg Environmental → Air → High stack, >150 meters 2 1
c353e6b3… EF 3.1 kg Environmental → Air → Unknown 2 1
fe0acd60… EF 3.1 kg Environmental → Air → Unknown 2 1
fe0acd60… EF 3.1 kg Environmental → Ground → Agricultural 2 1
fe0acd60… EF 3.1 kg Environmental → Ground → Unknown 2 1
fe0acd60… EF 3.1 kg Environmental → Water → Ocean 2 1
fe0acd60… EF 3.1 kg Environmental → Water → Surface water 2 1
fe0acd60… EF 3.1 kg Environmental → Water → Unknown 2 1
▶

Changes Applied
Elementary Flow Field Old Value New Value Comment
3e4d5089… cas_match_labels — {"51325-35-0":"exactMatch"} group_key=n,n'-[6-(5-nitro-2-furyl)-s-triazine-2,4-diyl]bisacetamide||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'51325-35-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bd091420f9a50a5b: {'51325-35-0': 'exactMatch'}
c353e6b3… cas_match_labels — {"51325-35-0":"exactMatch"} group_key=n,n'-[6-(5-nitro-2-furyl)-s-triazine-2,4-diyl]bisacetamide||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'51325-35-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bd091420f9a50a5b: {'51325-35-0': 'exactMatch'}
fe0acd60… cas_match_labels — {"51325-35-0":"exactMatch"} group_key=n,n'-[6-(5-nitro-2-furyl)-s-triazine-2,4-diyl]bisacetamide||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'51325-35-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bd091420f9a50a5b: {'51325-35-0': 'exactMatch'}
fe0acd60… cas_match_labels — {"51325-35-0":"exactMatch"} group_key=n,n'-[6-(5-nitro-2-furyl)-s-triazine-2,4-diyl]bisacetamide||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'51325-35-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bd091420f9a50a5b: {'51325-35-0': 'exactMatch'}
fe0acd60… cas_match_labels — {"51325-35-0":"exactMatch"} group_key=n,n'-[6-(5-nitro-2-furyl)-s-triazine-2,4-diyl]bisacetamide||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'51325-35-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bd091420f9a50a5b: {'51325-35-0': 'exactMatch'}
fe0acd60… cas_match_labels — {"51325-35-0":"exactMatch"} group_key=n,n'-[6-(5-nitro-2-furyl)-s-triazine-2,4-diyl]bisacetamide||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'51325-35-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bd091420f9a50a5b: {'51325-35-0': 'exactMatch'}
fe0acd60… cas_match_labels — {"51325-35-0":"exactMatch"} group_key=n,n'-[6-(5-nitro-2-furyl)-s-triazine-2,4-diyl]bisacetamide||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'51325-35-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bd091420f9a50a5b: {'51325-35-0': 'exactMatch'}
fe0acd60… cas_match_labels — {"51325-35-0":"exactMatch"} group_key=n,n'-[6-(5-nitro-2-furyl)-s-triazine-2,4-diyl]bisacetamide||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'51325-35-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bd091420f9a50a5b: {'51325-35-0': 'exactMatch'}
fe0acd60… cas_match_labels — {"51325-35-0":"exactMatch"} group_key=n,n'-[6-(5-nitro-2-furyl)-s-triazine-2,4-diyl]bisacetamide||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'51325-35-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bd091420f9a50a5b: {'51325-35-0': 'exactMatch'}
fe0acd60… cas_match_labels — {"51325-35-0":"exactMatch"} group_key=n,n'-[6-(5-nitro-2-furyl)-s-triazine-2,4-diyl]bisacetamide||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'51325-35-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bd091420f9a50a5b: {'51325-35-0': 'exactMatch'}
fe0acd60… cas_match_labels — {"51325-35-0":"exactMatch"} group_key=n,n'-[6-(5-nitro-2-furyl)-s-triazine-2,4-diyl]bisacetamide||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'51325-35-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bd091420f9a50a5b: {'51325-35-0': 'exactMatch'}
fe0acd60… cas_match_labels — {"51325-35-0":"exactMatch"} group_key=n,n'-[6-(5-nitro-2-furyl)-s-triazine-2,4-diyl]bisacetamide||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'51325-35-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bd091420f9a50a5b: {'51325-35-0': 'exactMatch'}
fe0acd60… cas_match_labels — {"51325-35-0":"exactMatch"} group_key=n,n'-[6-(5-nitro-2-furyl)-s-triazine-2,4-diyl]bisacetamide||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'51325-35-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bd091420f9a50a5b: {'51325-35-0': 'exactMatch'}

Flow Object JSON

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        "N-[4-acetamido-6-(5-nitro-2-furyl)-1,3,5-triazin-2-yl]acetamide",
        "N-[4-acetamido-6-(5-nitro-2-furyl)-s-triazin-2-yl]acetamide",
        "N-[4-acetamido-6-(5-nitrofuran-2-yl)-1,3,5-triazin-2-yl]acetamide",
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