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Octyl caprylate

UUID f4964480-50b3-42c5-a270-71b5ba646898
Deprecated yes
Replaced By 41c7991f-f852-4735-a451-999b2822f7ab
Flow Object IDfo-a9f2a5e3c6e6ca73
Source EF 3.1
Context Environmental → Ground → Unknown
CAS Numbers 2306-88-9
EC Numbers 218-980-5
prefLabel
Language Value Provenance
en Octyl caprylate
altLabel
Language Value Provenance
en 1-Octanol octanoate
en 1-Octyl octanoate
en <em>n</em>-Octyl <em>n</em>-octanoate
en <em>n</em>-Octyl caprylate
en Caprylic acid, octyl ester
en Caprylyl caprylate
en Cetiol 88
en Estol 1540EHC
en NSC 23957
en Octanoic acid, octyl ester
en Octyl octanathioate
en Octyl Octanoate
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey DJNTZVRUYMHBTD-UHFFFAOYSA-N
InChI InChI=1S/C16H32O2/c1-3-5-7-9-11-13-15-18-16(17)14-12-10-8-6-4-2/h3-15H2,1-2H3
IUPAC name caprylic acid octyl ester, octanoic acid octyl ester, octyl octanoate
Molecular formula C16H32O2
Molecular mass 256.43
Monoisotopic mass 256.24023
SMILES CCCCCCCCOC(=O)CCCCCCC

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 f4964480-50b3-42c5-a270-71b5ba646898 octyl octanoate

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=octyloctanoate||dimension=Environmental > media=Water > water_body=Surface water; cas=2306-88-9; added Common Chemistry CAS names as altLabel: 1-Octanol octanoate, 1-Octyl octanoate, <em>n</em>-Octyl <em>n</em>-octanoate, <em>n</em>-Octyl caprylate, Caprylic acid, octyl ester, Caprylyl caprylate, Cetiol 88, Estol 1540EHC, NSC 23957, Octanoic acid, octyl ester, Octyl caprylate, Octyl octanathioate; object_uuid=fo-a9f2a5e3c6e6ca73
cas_match_labels 1 consensus_match group_key=octyloctanoate||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'2306-88-9': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a9f2a5e3c6e6ca73: {'2306-88-9': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '1-Octanol octanoate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2306-88-9', 'https://commonchemistry.cas.org/detail?cas_rn=2306-88-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1-Octyl octanoate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2306-88-9', 'https://commonchemistry.cas.org/detail?cas_rn=2306-88-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>n</em>-Octyl <em>n</em>-octanoate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2306-88-9', 'https://commonchemistry.cas.org/detail?cas_rn=2306-88-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>n</em>-Octyl caprylate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2306-88-9', 'https://commonchemistry.cas.org/detail?cas_rn=2306-88-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Caprylic acid, octyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2306-88-9', 'https://commonchemistry.cas.org/detail?cas_rn=2306-88-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Caprylyl caprylate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2306-88-9', 'https://commonchemistry.cas.org/detail?cas_rn=2306-88-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Cetiol 88', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2306-88-9', 'https://commonchemistry.cas.org/detail?cas_rn=2306-88-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Estol 1540EHC', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2306-88-9', 'https://commonchemistry.cas.org/detail?cas_rn=2306-88-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 23957', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2306-88-9', 'https://commonchemistry.cas.org/detail?cas_rn=2306-88-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Octanoic acid, octyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2306-88-9', 'https://commonchemistry.cas.org/detail?cas_rn=2306-88-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Octyl caprylate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2306-88-9', 'https://commonchemistry.cas.org/detail?cas_rn=2306-88-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Octyl octanathioate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2306-88-9', 'https://commonchemistry.cas.org/detail?cas_rn=2306-88-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=octyloctanoate||dimension=Environmental > media=Water > water_body=Surface water; cas=2306-88-9; added Common Chemistry CAS names as altLabel: 1-Octanol octanoate, 1-Octyl octanoate, <em>n</em>-Octyl <em>n</em>-octanoate, <em>n</em>-Octyl caprylate, Caprylic acid, octyl ester, Caprylyl caprylate, Cetiol 88, Estol 1540EHC, NSC 23957, Octanoic acid, octyl ester, Octyl caprylate, Octyl octanathioate; object_uuid=fo-a9f2a5e3c6e6ca73
cas_match_labels None {'2306-88-9': 'exactMatch'} group_key=octyloctanoate||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'2306-88-9': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a9f2a5e3c6e6ca73: {'2306-88-9': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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