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Methyl Chloroacetate

UUID dcd41642-fc28-42f1-92d1-428abd2a2f38
Flow Object IDfo-b03d6212880120b5
Source EF 3.1
Context Environmental → Air → Unknown
CAS Numbers 96-34-4
EC Numbers 202-501-1
prefLabel
Language Value Provenance
en Methyl Chloroacetate
altLabel
Language Value Provenance
en 2-Chloroacetic acid methyl ester
en Acetic acid, 2-chloro-, methyl ester
en Acetic acid, chloro-, methyl ester
en Chloroacetic acid methyl ester
en Methyl 2-chloroacetate
en Methyl monochloracetate
en Methyl monochloroacetate
en Methyl α-chloroacetate
en Monochloroacetic acid methyl ester
en NSC 2635
References
Shared Properties
Predicate Value
InChIKey GAWAYYRQGQZKCR-UHFFFAOYSA-M, HTBWTUHYTKOIIW-VBKZILBWSA-N, QABLOFMHHSOFRJ-UHFFFAOYSA-N, WYJAEDOPWSZHNH-UHFFFAOYSA-N
InChI InChI=1S/C20H20O3/c1-2-3-4-7-13-23-20(22)17-12-8-11-16-18(17)14-9-5-6-10-15(14)19(16)21/h5-6,8-12H,2-4,7,13H2,1H3, InChI=1S/C21H23NO3/c1-3-14(2)20(12-23)22-21(24)25-13-19-17-10-6-4-8-15(17)16-9-5-7-11-18(16)19/h4-12,14,19-20H,3,13H2,1-2H3,(H,22,24)/t14-,20+/m0/s1, InChI=1S/C3H5ClO2/c1-2(4)3(5)6/h2H,1H3,(H,5,6)/p-1, InChI=1S/C3H5ClO2/c1-6-3(5)2-4/h2H2,1H3
IUPAC name 2-chloranylpropanoate, 2-chloroacetic acid methyl ester, 2-chloropropanoate, 2-chloropropionate, 9-ketofluorene-4-carboxylic acid hexyl ester, 9-oxo-4-fluorenecarboxylic acid hexyl ester, 9H-fluoren-9-ylmethyl N-[(1S,2S)-1-formyl-2-methyl-butyl]carbamate, 9H-fluoren-9-ylmethyl N-[(2S,3S)-3-methyl-1-oxidanylidene-pentan-2-yl]carbamate, 9H-fluoren-9-ylmethyl N-[(2S,3S)-3-methyl-1-oxopentan-2-yl]carbamate, N-[(1S,2S)-1-formyl-2-methyl-butyl]carbamic acid 9H-fluoren-9-ylmethyl ester, N-[(2S,3S)-3-methyl-1-oxopentan-2-yl]carbamic acid 9H-fluoren-9-ylmethyl ester, hexyl 9-oxidanylidenefluorene-4-carboxylate, hexyl 9-oxofluorene-4-carboxylate, methyl 2-chloranylethanoate, methyl 2-chloroacetate
Molecular formula C20H20O3, C21H23NO3, C3H4ClO2-, C3H5ClO2
SMILES CC(C(=O)[O-])Cl, CCC(C)C(C=O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13, CCCCCCOC(=O)C1=CC=CC2=C1C3=CC=CC=C3C2=O, CC[C@H](C)[C@@H](C=O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13, COC(=O)CCl

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 dcd41642-fc28-42f1-92d1-428abd2a2f38 methyl chloroacetate

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 methyl chloroacetate 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 1 consensus_match group_key=methylchloroacetate||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=96-34-4; added Common Chemistry CAS names as altLabel: 2-Chloroacetic acid methyl ester, Acetic acid, 2-chloro-, methyl ester, Acetic acid, chloro-, methyl ester, Chloroacetic acid methyl ester, Methyl 2-chloroacetate, Methyl monochloracetate, Methyl monochloroacetate, Methyl α-chloroacetate, Monochloroacetic acid methyl ester, NSC 2635; object_uuid=fo-b03d6212880120b5
cas_match_labels 1 consensus_match group_key=methylchloroacetate||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory', 'pubchem']; cas_sources={'96-34-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b03d6212880120b5: {'96-34-4': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaAir
strataUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '2-Chloroacetic acid methyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:96-34-4', 'https://commonchemistry.cas.org/detail?cas_rn=96-34-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Acetic acid, 2-chloro-, methyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:96-34-4', 'https://commonchemistry.cas.org/detail?cas_rn=96-34-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Acetic acid, chloro-, methyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:96-34-4', 'https://commonchemistry.cas.org/detail?cas_rn=96-34-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Chloroacetic acid methyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:96-34-4', 'https://commonchemistry.cas.org/detail?cas_rn=96-34-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Methyl 2-chloroacetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:96-34-4', 'https://commonchemistry.cas.org/detail?cas_rn=96-34-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Methyl monochloracetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:96-34-4', 'https://commonchemistry.cas.org/detail?cas_rn=96-34-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Methyl monochloroacetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:96-34-4', 'https://commonchemistry.cas.org/detail?cas_rn=96-34-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Methyl α-chloroacetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:96-34-4', 'https://commonchemistry.cas.org/detail?cas_rn=96-34-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Monochloroacetic acid methyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:96-34-4', 'https://commonchemistry.cas.org/detail?cas_rn=96-34-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 2635', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:96-34-4', 'https://commonchemistry.cas.org/detail?cas_rn=96-34-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=methylchloroacetate||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=96-34-4; added Common Chemistry CAS names as altLabel: 2-Chloroacetic acid methyl ester, Acetic acid, 2-chloro-, methyl ester, Acetic acid, chloro-, methyl ester, Chloroacetic acid methyl ester, Methyl 2-chloroacetate, Methyl monochloracetate, Methyl monochloroacetate, Methyl α-chloroacetate, Monochloroacetic acid methyl ester, NSC 2635; object_uuid=fo-b03d6212880120b5
cas_match_labels None {'96-34-4': 'exactMatch'} group_key=methylchloroacetate||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory', 'pubchem']; cas_sources={'96-34-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b03d6212880120b5: {'96-34-4': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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