L-5-morpholinomethyl-3-[(5-nitrofurfurylidene)amino]-2-oxazolidinone Hydrochloride

Flow Object ID fo-cf22d2dcb45207b4

Type Consensus

prefLabel

Label	Language
`L-5-morpholinomethyl-3-[(5-nitrofurfurylidene)amino]-2-oxazolidinone Hydrochloride`	en

CAS Numbers 3031-51-4

Changes Applied 13

Properties

Predicate	Value
InChIKey	`PPSVFZXMDMUIGB-FJUODKGNSA-N, PPSVFZXMDMUIGB-GSFIMPMYSA-N, PPSVFZXMDMUIGB-MERQFXBCSA-N`
InChI	`InChI=1S/C13H16N4O6.ClH/c18-13-16(14-7-10-1-2-12(22-10)17(19)20)9-11(23-13)8-15-3-5-21-6-4-15;/h1-2,7,11H,3-6,8-9H2;1H/b14-7+;, InChI=1S/C13H16N4O6.ClH/c18-13-16(14-7-10-1-2-12(22-10)17(19)20)9-11(23-13)8-15-3-5-21-6-4-15;/h1-2,7,11H,3-6,8-9H2;1H/b14-7+;/t11-;/m0./s1, InChI=1S/C13H16N4O6.ClH/c18-13-16(14-7-10-1-2-12(22-10)17(19)20)9-11(23-13)8-15-3-5-21-6-4-15;/h1-2,7,11H,3-6,8-9H2;1H/t11-;/m0./s1`
IUPAC name	(5S)-5-(4-morpholinylmethyl)-3-[(5-nitro-2-furanyl)methylideneamino]-2-oxazolidinone;hydrochloride, (5S)-5-(4-morpholinylmethyl)-3-[(E)-(5-nitro-2-furanyl)methylideneamino]-2-oxazolidinone;hydrochloride, (5S)-5-(morpholin-4-ylmethyl)-3-[(5-nitrofuran-2-yl)methylideneamino]-1,3-oxazolidin-2-one;hydrochloride, (5S)-5-(morpholin-4-ylmethyl)-3-[(E)-(5-nitrofuran-2-yl)methylideneamino]-1,3-oxazolidin-2-one;hydrochloride, (5S)-5-(morpholinomethyl)-3-[(5-nitro-2-furyl)methyleneamino]oxazolidin-2-one;hydrochloride, (5S)-5-(morpholinomethyl)-3-[(E)-(5-nitro-2-furyl)methyleneamino]oxazolidin-2-one;hydrochloride, 5-(4-morpholinylmethyl)-3-[(E)-(5-nitro-2-furanyl)methylideneamino]-2-oxazolidinone;hydrochloride, 5-(morpholin-4-ylmethyl)-3-[(E)-(5-nitrofuran-2-yl)methylideneamino]-1,3-oxazolidin-2-one;hydrochloride, 5-(morpholinomethyl)-3-[(E)-(5-nitro-2-furyl)methyleneamino]oxazolidin-2-one;hydrochloride
Molecular formula	`C13H17ClN4O6`
SMILES	`C1COCCN1CC2CN(C(=O)O2)/N=C/C3=CC=C(O3)[N+](=O)[O-].Cl, C1COCCN1CC2CN(C(=O)O2)N=CC3=CC=C(O3)[N+](=O)[O-].Cl, C1COCCN1C[C@H]2CN(C(=O)O2)/N=C/C3=CC=C(O3)[N+](=O)[O-].Cl, C1COCCN1C[C@H]2CN(C(=O)O2)N=CC3=CC=C(O3)[N+](=O)[O-].Cl`

References

Linked Elementary Flows

UUID	Source	Unit	Context	LCIA Factors	Consensus Changes
`1f314b94…`	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
`4d9a8790…`	EF 3.1	kg	Environmental → Air → Ground level → Urban (>1000 people/square mile)	2	1
`4d9a8790…`	EF 3.1	kg	Environmental → Air → High stack, >150 meters	2	1
`a9c0bde7…`	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
`4d9a8790…`	EF 3.1	kg	Environmental → Ground → Unknown	2	1
`4d9a8790…`	EF 3.1	kg	Environmental → Water → Ocean	2	1
`4d9a8790…`	EF 3.1	kg	Environmental → Water → Surface water	2	1
`4d9a8790…`	EF 3.1	kg	Environmental → Water → Unknown	2	1

▶

Changes Applied

Elementary Flow	Field	Old Value	New Value	Comment
`1f314b94…`	`cas_match_labels`	`—`	`{"3031-51-4":"exactMatch"}`	group_key=l-5-morpholinomethyl-3-[(5-nitrofurfurylidene)amino]-2-oxazolidinonehydrochloride\|\|dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=[]; cas_sources={'3031-51-4': []}; assigned CAS labels from group consensus; object_uuid=fo-cf22d2dcb45207b4: {'3031-51-4': 'exactMatch'}
`4d9a8790…`	`cas_match_labels`	`—`	`{"3031-51-4":"exactMatch"}`	group_key=l-5-morpholinomethyl-3-[(5-nitrofurfurylidene)amino]-2-oxazolidinonehydrochloride\|\|dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=[]; cas_sources={'3031-51-4': []}; assigned CAS labels from group consensus; object_uuid=fo-cf22d2dcb45207b4: {'3031-51-4': 'exactMatch'}
`4d9a8790…`	`cas_match_labels`	`—`	`{"3031-51-4":"exactMatch"}`	group_key=l-5-morpholinomethyl-3-[(5-nitrofurfurylidene)amino]-2-oxazolidinonehydrochloride\|\|dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=[]; cas_sources={'3031-51-4': []}; assigned CAS labels from group consensus; object_uuid=fo-cf22d2dcb45207b4: {'3031-51-4': 'exactMatch'}
`4d9a8790…`	`cas_match_labels`	`—`	`{"3031-51-4":"exactMatch"}`	group_key=l-5-morpholinomethyl-3-[(5-nitrofurfurylidene)amino]-2-oxazolidinonehydrochloride\|\|dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=[]; cas_sources={'3031-51-4': []}; assigned CAS labels from group consensus; object_uuid=fo-cf22d2dcb45207b4: {'3031-51-4': 'exactMatch'}
`4d9a8790…`	`cas_match_labels`	`—`	`{"3031-51-4":"exactMatch"}`	group_key=l-5-morpholinomethyl-3-[(5-nitrofurfurylidene)amino]-2-oxazolidinonehydrochloride\|\|dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=[]; cas_sources={'3031-51-4': []}; assigned CAS labels from group consensus; object_uuid=fo-cf22d2dcb45207b4: {'3031-51-4': 'exactMatch'}
`4d9a8790…`	`cas_match_labels`	`—`	`{"3031-51-4":"exactMatch"}`	group_key=l-5-morpholinomethyl-3-[(5-nitrofurfurylidene)amino]-2-oxazolidinonehydrochloride\|\|dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=[]; cas_sources={'3031-51-4': []}; assigned CAS labels from group consensus; object_uuid=fo-cf22d2dcb45207b4: {'3031-51-4': 'exactMatch'}
`4d9a8790…`	`cas_match_labels`	`—`	`{"3031-51-4":"exactMatch"}`	group_key=l-5-morpholinomethyl-3-[(5-nitrofurfurylidene)amino]-2-oxazolidinonehydrochloride\|\|dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=[]; cas_sources={'3031-51-4': []}; assigned CAS labels from group consensus; object_uuid=fo-cf22d2dcb45207b4: {'3031-51-4': 'exactMatch'}
`4d9a8790…`	`cas_match_labels`	`—`	`{"3031-51-4":"exactMatch"}`	group_key=l-5-morpholinomethyl-3-[(5-nitrofurfurylidene)amino]-2-oxazolidinonehydrochloride\|\|dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=[]; cas_sources={'3031-51-4': []}; assigned CAS labels from group consensus; object_uuid=fo-cf22d2dcb45207b4: {'3031-51-4': 'exactMatch'}
`a9c0bde7…`	`cas_match_labels`	`—`	`{"3031-51-4":"exactMatch"}`	group_key=l-5-morpholinomethyl-3-[(5-nitrofurfurylidene)amino]-2-oxazolidinonehydrochloride\|\|dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=[]; cas_sources={'3031-51-4': []}; assigned CAS labels from group consensus; object_uuid=fo-cf22d2dcb45207b4: {'3031-51-4': 'exactMatch'}
`fe0acd60…`	`cas_match_labels`	`—`	`{"3031-51-4":"exactMatch"}`	group_key=l-5-morpholinomethyl-3-[(5-nitrofurfurylidene)amino]-2-oxazolidinonehydrochloride\|\|dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=[]; cas_sources={'3031-51-4': []}; assigned CAS labels from group consensus; object_uuid=fo-cf22d2dcb45207b4: {'3031-51-4': 'exactMatch'}
`fe0acd60…`	`cas_match_labels`	`—`	`{"3031-51-4":"exactMatch"}`	group_key=l-5-morpholinomethyl-3-[(5-nitrofurfurylidene)amino]-2-oxazolidinonehydrochloride\|\|dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=[]; cas_sources={'3031-51-4': []}; assigned CAS labels from group consensus; object_uuid=fo-cf22d2dcb45207b4: {'3031-51-4': 'exactMatch'}
`fe0acd60…`	`cas_match_labels`	`—`	`{"3031-51-4":"exactMatch"}`	group_key=l-5-morpholinomethyl-3-[(5-nitrofurfurylidene)amino]-2-oxazolidinonehydrochloride\|\|dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=[]; cas_sources={'3031-51-4': []}; assigned CAS labels from group consensus; object_uuid=fo-cf22d2dcb45207b4: {'3031-51-4': 'exactMatch'}
`fe0acd60…`	`cas_match_labels`	`—`	`{"3031-51-4":"exactMatch"}`	group_key=l-5-morpholinomethyl-3-[(5-nitrofurfurylidene)amino]-2-oxazolidinonehydrochloride\|\|dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=[]; cas_sources={'3031-51-4': []}; assigned CAS labels from group consensus; object_uuid=fo-cf22d2dcb45207b4: {'3031-51-4': 'exactMatch'}

Flow Object JSON

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        "(5S)-5-(4-morpholinylmethyl)-3-[(E)-(5-nitro-2-furanyl)methylideneamino]-2-oxazolidinone;hydrochloride",
        "(5S)-5-(morpholin-4-ylmethyl)-3-[(5-nitrofuran-2-yl)methylideneamino]-1,3-oxazolidin-2-one;hydrochloride",
        "(5S)-5-(morpholin-4-ylmethyl)-3-[(E)-(5-nitrofuran-2-yl)methylideneamino]-1,3-oxazolidin-2-one;hydrochloride",
        "(5S)-5-(morpholinomethyl)-3-[(5-nitro-2-furyl)methyleneamino]oxazolidin-2-one;hydrochloride",
        "(5S)-5-(morpholinomethyl)-3-[(E)-(5-nitro-2-furyl)methyleneamino]oxazolidin-2-one;hydrochloride",
        "5-(4-morpholinylmethyl)-3-[(E)-(5-nitro-2-furanyl)methylideneamino]-2-oxazolidinone;hydrochloride",
        "5-(morpholin-4-ylmethyl)-3-[(E)-(5-nitrofuran-2-yl)methylideneamino]-1,3-oxazolidin-2-one;hydrochloride",
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null
}