Di-ester Reaction Products Of Linear And Branched Octyl Alcohol With Hexanedioic Acid

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Di-ester Reaction Products Of Linear And Branched Octyl Alcohol With Hexanedioic Acid

UUID b8a53609-5b53-4bbb-9718-95325b10ec17

Flow Object ID fo-dece7aed9e3bee7f

Source EF 3.1

Context Environmental → Air → Unknown

CAS Numbers 1330-86-5

EC Numbers 215-553-5

prefLabel

Language	Value	Provenance
`en`	`Di-ester Reaction Products Of Linear And Branched Octyl Alcohol With Hexanedioic Acid`

altLabel ⓘ

Language	Value	Provenance
`en`	`Adipic acid, diisooctyl ester`
`en`	`Adipol 10A`
`en`	`DB 32`
`en`	`DB 32 (ester)`
`en`	`DIOA`
`en`	`Diisooctyl adipate`
`en`	`Hatcol 2906`
`en`	`Hexanedioic acid, 1,6-diisooctyl ester`
`en`	`Hexanedioic acid, diisooctyl ester`
`en`	`Isooctyl alcohol, adipate (2:1)`

References

Shared Properties

Predicate	Value
InChIKey	`AZXBHGKSTNMAMK-UHFFFAOYSA-N, BXGUUVBSRYSHDJ-UHFFFAOYSA-N, CJFLBOQMPJCWLR-UHFFFAOYSA-N, NLDIKPYEHYRZBW-UHFFFAOYSA-L, RTUMJAGKSDIHOW-UHFFFAOYSA-N`
InChI	InChI=1S/C10H14O/c1-7(2)10-8(3)5-4-6-9(10)11/h4-7,11H,1-3H3, InChI=1S/C20H38O4.2CH4/c1-3-5-7-9-13-17-23-19(21)15-11-12-16-20(22)24-18-14-10-8-6-4-2;;/h3-18H2,1-2H3;2*1H4, InChI=1S/C22H42O4/c1-18(2)12-7-5-9-15-22(21(25)26,17-11-14-20(23)24)16-10-6-8-13-19(3)4/h18-19H,5-17H2,1-4H3,(H,23,24)(H,25,26)/p-2, InChI=1S/C22H42O4/c1-19(2)13-7-5-11-17-25-21(23)15-9-10-16-22(24)26-18-12-6-8-14-20(3)4/h19-20H,5-18H2,1-4H3, InChI=1S/C22H42O4/c1-5-7-9-11-15-19(3)25-21(23)17-13-14-18-22(24)26-20(4)16-12-10-8-6-2/h19-20H,5-18H2,1-4H3
IUPAC name	2,2-bis(6-methylheptyl)adipate, 2,2-bis(6-methylheptyl)hexanedioate, 2-isopropyl-3-methyl-phenol, 3-methyl-2-propan-2-yl-phenol, 3-methyl-2-propan-2-ylphenol, adipic acid bis(1-methylheptyl) ester, adipic acid bis(6-methylheptyl) ester, adipic acid diheptyl ester;methane, bis(1-methylheptyl) hexanedioate, bis(6-methylheptyl) hexanedioate, diheptyl hexanedioate;methane, dioctan-2-yl hexanedioate, hexanedioic acid bis(6-methylheptyl) ester, hexanedioic acid diheptyl ester;methane, hexanedioic acid dioctan-2-yl ester
Molecular formula	`C10H14O, C22H40O4-2, C22H42O4, C22H46O4`
SMILES	`C.C.CCCCCCCOC(=O)CCCCC(=O)OCCCCCCC, CC(C)CCCCCC(CCCCCC(C)C)(CCCC(=O)[O-])C(=O)[O-], CC(C)CCCCCOC(=O)CCCCC(=O)OCCCCCC(C)C, CC1=C(C(=CC=C1)O)C(C)C, CCCCCCC(C)OC(=O)CCCCC(=O)OC(C)CCCCCC`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`b8a53609-5b53-4bbb-9718-95325b10ec17`	di-ester reaction products of linear and branched octyl alcohol with hexanedioic acid

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	di-ester reaction products of linear and branched octyl alcohol with hexanedioic acid	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=di-esterreactionproductsoflinearandbranchedoctylalcoholwithhexanedioicacid\|\|dimension=Environmental > media=Ground > geography=Unknown; cas=1330-86-5; added Common Chemistry CAS names as altLabel: Adipic acid, diisooctyl ester, Adipol 10A, DB 32, DB 32 (ester), DIOA, Diisooctyl adipate, Hatcol 2906, Hexanedioic acid, 1,6-diisooctyl ester, Hexanedioic acid, diisooctyl ester, Isooctyl alcohol, adipate (2:1); object_uuid=fo-dece7aed9e3bee7f
`cas_match_labels`	1	`—`	consensus_match	group_key=di-esterreactionproductsoflinearandbranchedoctylalcoholwithhexanedioicacid\|\|dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory']; cas_sources={'1330-86-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-dece7aed9e3bee7f: {'1330-86-5': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Air
strata	Unknown

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`None`	[{'@value': 'Adipic acid, diisooctyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1330-86-5', 'https://commonchemistry.cas.org/detail?cas_rn=1330-86-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Adipol 10A', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1330-86-5', 'https://commonchemistry.cas.org/detail?cas_rn=1330-86-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'DB 32', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1330-86-5', 'https://commonchemistry.cas.org/detail?cas_rn=1330-86-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'DB 32 (ester)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1330-86-5', 'https://commonchemistry.cas.org/detail?cas_rn=1330-86-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'DIOA', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1330-86-5', 'https://commonchemistry.cas.org/detail?cas_rn=1330-86-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Diisooctyl adipate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1330-86-5', 'https://commonchemistry.cas.org/detail?cas_rn=1330-86-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Hatcol 2906', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1330-86-5', 'https://commonchemistry.cas.org/detail?cas_rn=1330-86-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Hexanedioic acid, 1,6-diisooctyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1330-86-5', 'https://commonchemistry.cas.org/detail?cas_rn=1330-86-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Hexanedioic acid, diisooctyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1330-86-5', 'https://commonchemistry.cas.org/detail?cas_rn=1330-86-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Isooctyl alcohol, adipate (2:1)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1330-86-5', 'https://commonchemistry.cas.org/detail?cas_rn=1330-86-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=di-esterreactionproductsoflinearandbranchedoctylalcoholwithhexanedioicacid\|\|dimension=Environmental > media=Ground > geography=Unknown; cas=1330-86-5; added Common Chemistry CAS names as altLabel: Adipic acid, diisooctyl ester, Adipol 10A, DB 32, DB 32 (ester), DIOA, Diisooctyl adipate, Hatcol 2906, Hexanedioic acid, 1,6-diisooctyl ester, Hexanedioic acid, diisooctyl ester, Isooctyl alcohol, adipate (2:1); object_uuid=fo-dece7aed9e3bee7f
`cas_match_labels`	`None`	`{'1330-86-5': 'exactMatch'}`	group_key=di-esterreactionproductsoflinearandbranchedoctylalcoholwithhexanedioicacid\|\|dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory']; cas_sources={'1330-86-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-dece7aed9e3bee7f: {'1330-86-5': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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