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Filex

UUID 916a8ad2-4daf-4626-8938-65fa71f9fc44
Flow Object IDfo-4e1839d366c2a0ce
Source EF 3.1
Context Environmental → Air → Unknown
CAS Numbers 25606-41-1
EC Numbers 247-125-9
prefLabel
Language Value Provenance
en Filex
altLabel
Language Value Provenance
en Carbamic acid, <em>N</em>-[3-(dimethylamino)propyl]-, propyl ester, hydrochloride (1:1)
en Carbamic acid, [3-(dimethylamino)propyl]-, propyl ester, monohydrochloride
en Gentracur
en Previcur Flex
en Previcur N
en Propyl 3-(dimethylamino)propylcarbamate monohydrochloride
en SN 66752
en Propamocarb hydrochloride
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey MKIMSXGUTQTKJU-UHFFFAOYSA-N
InChI InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H
IUPAC name dimethyl-[3-(propoxycarbonylamino)propyl]ammonium chloride, dimethyl-[3-(propoxycarbonylamino)propyl]azanium chloride, dimethyl-[3-[[oxo(propoxy)methyl]amino]propyl]ammonium chloride
Molecular formula C9H21ClN2O2, C9H21N2O2.Cl
Molecular mass 224.732
Monoisotopic mass 224.12916
SMILES CCCOC(=O)NCCC[NH+](C)C.[Cl-]

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 916a8ad2-4daf-4626-8938-65fa71f9fc44 propyl [3-(dimethylamino)propyl]carbamate monohydrochloride

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 propyl [3-(dimethylamino)propyl]carbamate monohydrochloride Emissions/Emissions to air/Emissions to air, unspecified kg exactMatch

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field Change Count Latest Time Transformers Latest Comment
altLabel 2 consensus_match group_key=propyl[3-(dimethylamino)propyl]carbamatemonohydrochloride||dimension=Environmental > media=Air > indoor=Unknown; cas=25606-41-1; added Common Chemistry CAS names as altLabel: Carbamic acid, <em>N</em>-[3-(dimethylamino)propyl]-, propyl ester, hydrochloride (1:1), Carbamic acid, [3-(dimethylamino)propyl]-, propyl ester, monohydrochloride, Gentracur, Previcur Flex, Previcur N, Propyl 3-(dimethylamino)propylcarbamate monohydrochloride, SN 66752; object_uuid=fo-4e1839d366c2a0ce
cas_match_labels 1 consensus_match group_key=propyl[3-(dimethylamino)propyl]carbamatemonohydrochloride||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'25606-41-1': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-4e1839d366c2a0ce: {'25606-41-1': 'exactMatch'}
prefLabel 1 consensus_match cas=25606-41-1; cc_chebi_agreed_name='Propamocarb hydrochloride'; object_uuid=fo-4e1839d366c2a0ce

Context Attributes

AttributeValue
dimensionEnvironmental
mediaAir
strataUnknown

Consensus Changes

Field Old Value New Value Comment
prefLabel [{'@value': 'Propyl [3-(dimethylamino)propyl]carbamate Monohydrochloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'bootstrap_labels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'legacy name field'}}] [{'@value': 'Propamocarb hydrochloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25606-41-1'], 'prov:wasDerivedFrom': 'Common Chemistry / ChEBI primary name agreement'}}] cas=25606-41-1; cc_chebi_agreed_name='Propamocarb hydrochloride'; object_uuid=fo-4e1839d366c2a0ce
altLabel None [{'@value': 'Propyl [3-(dimethylamino)propyl]carbamate Monohydrochloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original name retained as altLabel'}}] cas=25606-41-1; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-4e1839d366c2a0ce
altLabel [{'@value': 'Propyl [3-(dimethylamino)propyl]carbamate Monohydrochloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original name retained as altLabel'}}] [{'@value': 'Carbamic acid, <em>N</em>-[3-(dimethylamino)propyl]-, propyl ester, hydrochloride (1:1)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25606-41-1', 'https://commonchemistry.cas.org/detail?cas_rn=25606-41-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Carbamic acid, [3-(dimethylamino)propyl]-, propyl ester, monohydrochloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25606-41-1', 'https://commonchemistry.cas.org/detail?cas_rn=25606-41-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Gentracur', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25606-41-1', 'https://commonchemistry.cas.org/detail?cas_rn=25606-41-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Previcur Flex', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25606-41-1', 'https://commonchemistry.cas.org/detail?cas_rn=25606-41-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Previcur N', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25606-41-1', 'https://commonchemistry.cas.org/detail?cas_rn=25606-41-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Propyl 3-(dimethylamino)propylcarbamate monohydrochloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25606-41-1', 'https://commonchemistry.cas.org/detail?cas_rn=25606-41-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'SN 66752', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25606-41-1', 'https://commonchemistry.cas.org/detail?cas_rn=25606-41-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=propyl[3-(dimethylamino)propyl]carbamatemonohydrochloride||dimension=Environmental > media=Air > indoor=Unknown; cas=25606-41-1; added Common Chemistry CAS names as altLabel: Carbamic acid, <em>N</em>-[3-(dimethylamino)propyl]-, propyl ester, hydrochloride (1:1), Carbamic acid, [3-(dimethylamino)propyl]-, propyl ester, monohydrochloride, Gentracur, Previcur Flex, Previcur N, Propyl 3-(dimethylamino)propylcarbamate monohydrochloride, SN 66752; object_uuid=fo-4e1839d366c2a0ce
cas_match_labels None {'25606-41-1': 'exactMatch'} group_key=propyl[3-(dimethylamino)propyl]carbamatemonohydrochloride||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'25606-41-1': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-4e1839d366c2a0ce: {'25606-41-1': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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  "general_comment": "Correct mapping CAS and flow to be verified: yet unclear whether this is the sodium-, hydrochloride-, calcium-, potassium- or other salt or the pure substance that is emitted. Note that the CAS No is the relevant identifier, to which also the ILCD LCIA characterisation factors relate. Reference elementary flow of the International Reference Life Cycle Data System (ILCD).",
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