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A Mixture Of Branched And Linear C7-c9 Alkyl 3-[3-(2h-benzotriazol-2-yl)-5-(1,1-dimethylethyl)-4-hydroxyphenyl]propionates

UUID b2d32d16-31ce-4f49-a5ed-ff79f61f5281
Flow Object IDfo-2cc91ac766a5be7f
Source EF 3.1
Context Environmental → Ground → Agricultural
CAS Numbers 127519-17-9
EC Numbers 407-000-3
prefLabel
Language Value Provenance
en A Mixture Of Branched And Linear C7-c9 Alkyl 3-[3-(2h-benzotriazol-2-yl)-5-(1,1-dimethylethyl)-4-hydroxyphenyl]propionates
altLabel ⓘ
Language Value Provenance
en Benzenepropanoic acid, 3-(2<em>H</em>-benzotriazol-2-yl)-5-(1,1-dimethylethyl)-4-hydroxy-, C<sub>7-9</sub>-branched and linear alkyl esters
References
Shared Properties
Predicate Value
InChIKey HMILXGPZMQDAKE-UHFFFAOYSA-N, OSGATCNZNQUOJU-UHFFFAOYSA-N, XQAABEDPVQWFPN-UHFFFAOYSA-N
InChI InChI=1S/C21H34O3/c1-17(2)12-8-7-11-15-24-19(22)21(23,16-20(3,4)5)18-13-9-6-10-14-18/h6,9-10,13-14,17,23H,7-8,11-12,15-16H2,1-5H3, InChI=1S/C26H35N3O3/c1-6-18(2)10-9-15-32-24(30)14-13-19-16-20(26(3,4)5)25(31)23(17-19)29-27-21-11-7-8-12-22(21)28-29/h7-8,11-12,16-18,31H,6,9-10,13-15H2,1-5H3, InChI=1S/C27H37N3O3/c1-5-6-7-8-9-12-17-33-25(31)16-15-20-18-21(27(2,3)4)26(32)24(19-20)30-28-22-13-10-11-14-23(22)29-30/h10-11,13-14,18-19,32H,5-9,12,15-17H2,1-4H3
IUPAC name 2-hydroxy-4,4-dimethyl-2-phenyl-valeric acid 6-methylheptyl ester, 2-hydroxy-4,4-dimethyl-2-phenylpentanoic acid 6-methylheptyl ester, 3-[3-(2-benzotriazolyl)-5-tert-butyl-4-hydroxyphenyl]propanoic acid 4-methylhexyl ester, 3-[3-(2-benzotriazolyl)-5-tert-butyl-4-hydroxyphenyl]propanoic acid octyl ester, 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxy-phenyl]propionic acid 4-methylhexyl ester, 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxy-phenyl]propionic acid octyl ester, 4-methylhexyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxy-phenyl]propanoate, 4-methylhexyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]propanoate, 4-methylhexyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-oxidanyl-phenyl]propanoate, 6-methylheptyl 2-hydroxy-4,4-dimethyl-2-phenyl-pentanoate, 6-methylheptyl 2-hydroxy-4,4-dimethyl-2-phenylpentanoate, 6-methylheptyl 4,4-dimethyl-2-oxidanyl-2-phenyl-pentanoate, octyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxy-phenyl]propanoate, octyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]propanoate, octyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-oxidanyl-phenyl]propanoate
Molecular formula C21H34O3, C26H35N3O3, C27H37N3O3
SMILES CC(C)CCCCCOC(=O)C(CC(C)(C)C)(C1=CC=CC=C1)O, CCC(C)CCCOC(=O)CCC1=CC(=C(C(=C1)N2N=C3C=CC=CC3=N2)O)C(C)(C)C, CCCCCCCCOC(=O)CCC1=CC(=C(C(=C1)N2N=C3C=CC=CC3=N2)O)C(C)(C)C

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 b2d32d16-31ce-4f49-a5ed-ff79f61f5281 a mixture of branched and linear c7-c9 alkyl 3-[3-(2h-benzotriazol-2-yl)-5-(1,1-dimethylethyl)-4-hydroxyphenyl]propionates

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 a mixture of branched and linear c7-c9 alkyl 3-[3-(2h-benzotriazol-2-yl)-5-(1,1-dimethylethyl)-4-hydroxyphenyl]propionates Emissions/Emissions to soil/Emissions to agricultural soil 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=amixtureofbranchedandlinearc7-c9alkyl3-[3-(2h-benzotriazol-2-yl)-5-(1,1-dimethylethyl)-4-hydroxyphenyl]propionates||dimension=Environmental > media=Ground > geography=Unknown; cas=127519-17-9; added Common Chemistry CAS names as altLabel: Benzenepropanoic acid, 3-(2<em>H</em>-benzotriazol-2-yl)-5-(1,1-dimethylethyl)-4-hydroxy-, C<sub>7-9</sub>-branched and linear alkyl esters; object_uuid=fo-2cc91ac766a5be7f
cas_match_labels 1 — consensus_match group_key=amixtureofbranchedandlinearc7-c9alkyl3-[3-(2h-benzotriazol-2-yl)-5-(1,1-dimethylethyl)-4-hydroxyphenyl]propionates||dimension=Environmental > media=Ground > geography=Unknown; group_sources=[]; cas_sources={'127519-17-9': []}; assigned CAS labels from group consensus; object_uuid=fo-2cc91ac766a5be7f: {'127519-17-9': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyAgricultural

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': 'Benzenepropanoic acid, 3-(2<em>H</em>-benzotriazol-2-yl)-5-(1,1-dimethylethyl)-4-hydroxy-, C<sub>7-9</sub>-branched and linear alkyl esters', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:127519-17-9', 'https://commonchemistry.cas.org/detail?cas_rn=127519-17-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=amixtureofbranchedandlinearc7-c9alkyl3-[3-(2h-benzotriazol-2-yl)-5-(1,1-dimethylethyl)-4-hydroxyphenyl]propionates||dimension=Environmental > media=Ground > geography=Unknown; cas=127519-17-9; added Common Chemistry CAS names as altLabel: Benzenepropanoic acid, 3-(2<em>H</em>-benzotriazol-2-yl)-5-(1,1-dimethylethyl)-4-hydroxy-, C<sub>7-9</sub>-branched and linear alkyl esters; object_uuid=fo-2cc91ac766a5be7f
cas_match_labels None {'127519-17-9': 'exactMatch'} group_key=amixtureofbranchedandlinearc7-c9alkyl3-[3-(2h-benzotriazol-2-yl)-5-(1,1-dimethylethyl)-4-hydroxyphenyl]propionates||dimension=Environmental > media=Ground > geography=Unknown; group_sources=[]; cas_sources={'127519-17-9': []}; assigned CAS labels from group consensus; object_uuid=fo-2cc91ac766a5be7f: {'127519-17-9': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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        "2-hydroxy-4,4-dimethyl-2-phenylpentanoic acid 6-methylheptyl ester",
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        "3-[3-(2-benzotriazolyl)-5-tert-butyl-4-hydroxyphenyl]propanoic acid octyl ester",
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