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2-methylpropyl-(r)-2-hydroxypropanoate

UUID 6e457e28-9cc8-4d11-834b-d2300e55e37b
Deprecated yes
Replaced By ef9160e0-f49d-4e08-9424-11fd6e99d5af
Flow Object IDfo-7f62d7bfbb9e8c81
Source EF 3.1
Context Environmental → Water → Unknown
CAS Numbers 61597-96-4
EC Numbers 407-770-0
prefLabel
Language Value Provenance
en 2-methylpropyl-(r)-2-hydroxypropanoate
altLabel ⓘ
Language Value Provenance
en (+)-Isobutyl D-lactate
en (+)-Isobutyl lactate
en (<em>R</em>)-(+)-Isobutyl lactate
en (<em>R</em>)-(+)-Lactic acid isobutyl ester
en (<em>R</em>)-Lactic acid isobutyl ester
en 2-Methylpropyl (2R)-2-hydroxypropanoate
en <span class="text-smallcaps">D</span>-Isobutyl lactate
en Isobutyl (<em>R</em>)-2-hydroxypropionate
en Isobutyl (<em>R</em>)-lactate
en Propanoic acid, 2-hydroxy-, 2-methylpropyl ester, (2<em>R</em>)-
en Propanoic acid, 2-hydroxy-, 2-methylpropyl ester, (<em>R</em>)-
References
Shared Properties
Predicate Value
InChIKey WBPAQKQBUKYCJS-UHFFFAOYSA-N, WBPAQKQBUKYCJS-ZCFIWIBFSA-N
InChI InChI=1S/C7H14O3/c1-5(2)4-10-7(9)6(3)8/h5-6,8H,4H2,1-3H3, InChI=1S/C7H14O3/c1-5(2)4-10-7(9)6(3)8/h5-6,8H,4H2,1-3H3/t6-/m1/s1
IUPAC name (2R)-2-hydroxypropanoic acid 2-methylpropyl ester, (2R)-2-hydroxypropionic acid isobutyl ester, 2-hydroxypropanoic acid 2-methylpropyl ester, 2-hydroxypropionic acid isobutyl ester, 2-methylpropyl (2R)-2-hydroxypropanoate, 2-methylpropyl (2R)-2-oxidanylpropanoate, 2-methylpropyl 2-hydroxypropanoate, 2-methylpropyl 2-oxidanylpropanoate, isobutyl (2R)-2-hydroxypropanoate, isobutyl 2-hydroxypropanoate
Molecular formula C7H14O3
SMILES CC(C)COC(=O)C(C)O, C[C@H](C(=O)OCC(C)C)O

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 6e457e28-9cc8-4d11-834b-d2300e55e37b 2-methylpropyl-(r)-2-hydroxypropanoate

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=2-methylpropyl-(r)-2-hydroxypropanoate||dimension=Environmental > media=Ground > geography=Unknown; cas=61597-96-4; added Common Chemistry CAS names as altLabel: (+)-Isobutyl D-lactate, (+)-Isobutyl lactate, (<em>R</em>)-(+)-Isobutyl lactate, (<em>R</em>)-(+)-Lactic acid isobutyl ester, (<em>R</em>)-Lactic acid isobutyl ester, 2-Methylpropyl (2R)-2-hydroxypropanoate, <span class="text-smallcaps">D</span>-Isobutyl lactate, Isobutyl (<em>R</em>)-2-hydroxypropionate, Isobutyl (<em>R</em>)-lactate, Propanoic acid, 2-hydroxy-, 2-methylpropyl ester, (2<em>R</em>)-, Propanoic acid, 2-hydroxy-, 2-methylpropyl ester, (<em>R</em>)-; object_uuid=fo-7f62d7bfbb9e8c81
cas_match_labels 1 — consensus_match group_key=2-methylpropyl-(r)-2-hydroxypropanoate||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['pubchem']; cas_sources={'61597-96-4': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7f62d7bfbb9e8c81: {'61597-96-4': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '(+)-Isobutyl D-lactate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61597-96-4', 'https://commonchemistry.cas.org/detail?cas_rn=61597-96-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '(+)-Isobutyl lactate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61597-96-4', 'https://commonchemistry.cas.org/detail?cas_rn=61597-96-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '(<em>R</em>)-(+)-Isobutyl lactate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61597-96-4', 'https://commonchemistry.cas.org/detail?cas_rn=61597-96-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '(<em>R</em>)-(+)-Lactic acid isobutyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61597-96-4', 'https://commonchemistry.cas.org/detail?cas_rn=61597-96-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '(<em>R</em>)-Lactic acid isobutyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61597-96-4', 'https://commonchemistry.cas.org/detail?cas_rn=61597-96-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Methylpropyl (2R)-2-hydroxypropanoate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61597-96-4', 'https://commonchemistry.cas.org/detail?cas_rn=61597-96-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<span class="text-smallcaps">D</span>-Isobutyl lactate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61597-96-4', 'https://commonchemistry.cas.org/detail?cas_rn=61597-96-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Isobutyl (<em>R</em>)-2-hydroxypropionate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61597-96-4', 'https://commonchemistry.cas.org/detail?cas_rn=61597-96-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Isobutyl (<em>R</em>)-lactate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61597-96-4', 'https://commonchemistry.cas.org/detail?cas_rn=61597-96-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Propanoic acid, 2-hydroxy-, 2-methylpropyl ester, (2<em>R</em>)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61597-96-4', 'https://commonchemistry.cas.org/detail?cas_rn=61597-96-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Propanoic acid, 2-hydroxy-, 2-methylpropyl ester, (<em>R</em>)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61597-96-4', 'https://commonchemistry.cas.org/detail?cas_rn=61597-96-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=2-methylpropyl-(r)-2-hydroxypropanoate||dimension=Environmental > media=Ground > geography=Unknown; cas=61597-96-4; added Common Chemistry CAS names as altLabel: (+)-Isobutyl D-lactate, (+)-Isobutyl lactate, (<em>R</em>)-(+)-Isobutyl lactate, (<em>R</em>)-(+)-Lactic acid isobutyl ester, (<em>R</em>)-Lactic acid isobutyl ester, 2-Methylpropyl (2R)-2-hydroxypropanoate, <span class="text-smallcaps">D</span>-Isobutyl lactate, Isobutyl (<em>R</em>)-2-hydroxypropionate, Isobutyl (<em>R</em>)-lactate, Propanoic acid, 2-hydroxy-, 2-methylpropyl ester, (2<em>R</em>)-, Propanoic acid, 2-hydroxy-, 2-methylpropyl ester, (<em>R</em>)-; object_uuid=fo-7f62d7bfbb9e8c81
cas_match_labels None {'61597-96-4': 'exactMatch'} group_key=2-methylpropyl-(r)-2-hydroxypropanoate||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['pubchem']; cas_sources={'61597-96-4': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7f62d7bfbb9e8c81: {'61597-96-4': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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