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4,4',4''-(1-methylpropan-1-yl-3-ylidene)tris(2-cyclohexyl-5-methylphenol)

UUID 3936a87a-8294-4c2f-a94c-a918b1a62505
Flow Object IDfo-a3963a87a044a1f4
Source EF 3.1
Context Environmental → Air → Ground level → Urban (>1000 people/square mile)
CAS Numbers 111850-25-0
EC Numbers 407-460-5
prefLabel
Language Value Provenance
en 4,4',4''-(1-methylpropan-1-yl-3-ylidene)tris(2-cyclohexyl-5-methylphenol)
altLabel ⓘ
Language Value Provenance
en 1,1,3-Tri(3-cyclohexyl-4-hydroxy-6-methylphenyl)butane
en 1,1,3-Tris(2-methyl-4-hydroxy-5-cyclohexylphenyl)butane
en 1,1,3-Tris(2-methyl-5-cyclohexyl-4-hydroxyphenyl)butane
en 1,1,3-Tris(3′-cyclohexyl-4′-hydroxy-6′-methylphenyl)butane
en 1,1,3-Tris(5-cyclohexyl-4-hydroxy-2-methylphenyl)butane
en 4,4′,4′′-(1-Methyl-1-propanyl-3-ylidene)tris[2-cyclohexyl-5-methylphenol]
en ADK-ARKLS DH 43
en ARKLS-DH 43
en DH 43
en Phenol, 4,4′,4′′-(1-methyl-1-propanyl-3-ylidene)tris[2-cyclohexyl-5-methyl-
References
Shared Properties
Predicate Value
InChIKey PRMDDINQJXOMDC-MHZLTWQESA-N, PRMDDINQJXOMDC-UHFFFAOYSA-N
InChI InChI=1S/C43H58O3/c1-27(34-24-37(41(44)21-28(34)2)31-14-8-5-9-15-31)20-40(35-25-38(42(45)22-29(35)3)32-16-10-6-11-17-32)36-26-39(43(46)23-30(36)4)33-18-12-7-13-19-33/h21-27,31-33,40,44-46H,5-20H2,1-4H3, InChI=1S/C43H58O3/c1-27(34-24-37(41(44)21-28(34)2)31-14-8-5-9-15-31)20-40(35-25-38(42(45)22-29(35)3)32-16-10-6-11-17-32)36-26-39(43(46)23-30(36)4)33-18-12-7-13-19-33/h21-27,31-33,40,44-46H,5-20H2,1-4H3/t27-/m0/s1
IUPAC name 4-[(1S)-3,3-bis(5-cyclohexyl-4-hydroxy-2-methyl-phenyl)-1-methyl-propyl]-2-cyclohexyl-5-methyl-phenol, 4-[(2S)-4,4-bis(5-cyclohexyl-2-methyl-4-oxidanyl-phenyl)butan-2-yl]-2-cyclohexyl-5-methyl-phenol, 4-[(2S)-4,4-bis(5-cyclohexyl-4-hydroxy-2-methylphenyl)butan-2-yl]-2-cyclohexyl-5-methylphenol, 4-[3,3-bis(5-cyclohexyl-4-hydroxy-2-methyl-phenyl)-1-methyl-propyl]-2-cyclohexyl-5-methyl-phenol, 4-[4,4-bis(5-cyclohexyl-2-methyl-4-oxidanyl-phenyl)butan-2-yl]-2-cyclohexyl-5-methyl-phenol, 4-[4,4-bis(5-cyclohexyl-4-hydroxy-2-methylphenyl)butan-2-yl]-2-cyclohexyl-5-methylphenol
Molecular formula C43H58O3
SMILES CC1=CC(=C(C=C1C(C)CC(C2=CC(=C(C=C2C)O)C3CCCCC3)C4=CC(=C(C=C4C)O)C5CCCCC5)C6CCCCC6)O, CC1=CC(=C(C=C1[C@@H](C)CC(C2=CC(=C(C=C2C)O)C3CCCCC3)C4=CC(=C(C=C4C)O)C5CCCCC5)C6CCCCC6)O

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 3936a87a-8294-4c2f-a94c-a918b1a62505 4,4',4''-(1-methylpropan-1-yl-3-ylidene)tris(2-cyclohexyl-5-methylphenol)

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 4,4',4''-(1-methylpropan-1-yl-3-ylidene)tris(2-cyclohexyl-5-methylphenol) Emissions/Emissions to air/Emissions to urban air close to ground 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=4,4',4''-(1-methylpropan-1-yl-3-ylidene)tris(2-cyclohexyl-5-methylphenol)||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=111850-25-0; added Common Chemistry CAS names as altLabel: 1,1,3-Tri(3-cyclohexyl-4-hydroxy-6-methylphenyl)butane, 1,1,3-Tris(2-methyl-4-hydroxy-5-cyclohexylphenyl)butane, 1,1,3-Tris(2-methyl-5-cyclohexyl-4-hydroxyphenyl)butane, 1,1,3-Tris(3′-cyclohexyl-4′-hydroxy-6′-methylphenyl)butane, 1,1,3-Tris(5-cyclohexyl-4-hydroxy-2-methylphenyl)butane, 4,4′,4′′-(1-Methyl-1-propanyl-3-ylidene)tris[2-cyclohexyl-5-methylphenol], ADK-ARKLS DH 43, ARKLS-DH 43, DH 43, Phenol, 4,4′,4′′-(1-methyl-1-propanyl-3-ylidene)tris[2-cyclohexyl-5-methyl-; object_uuid=fo-a3963a87a044a1f4
cas_match_labels 1 — consensus_match group_key=4,4',4''-(1-methylpropan-1-yl-3-ylidene)tris(2-cyclohexyl-5-methylphenol)||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'111850-25-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a3963a87a044a1f4: {'111850-25-0': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaAir
strataGround level
population_densityUrban (>1000 people/square mile)

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '1,1,3-Tri(3-cyclohexyl-4-hydroxy-6-methylphenyl)butane', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111850-25-0', 'https://commonchemistry.cas.org/detail?cas_rn=111850-25-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,1,3-Tris(2-methyl-4-hydroxy-5-cyclohexylphenyl)butane', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111850-25-0', 'https://commonchemistry.cas.org/detail?cas_rn=111850-25-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,1,3-Tris(2-methyl-5-cyclohexyl-4-hydroxyphenyl)butane', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111850-25-0', 'https://commonchemistry.cas.org/detail?cas_rn=111850-25-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,1,3-Tris(3′-cyclohexyl-4′-hydroxy-6′-methylphenyl)butane', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111850-25-0', 'https://commonchemistry.cas.org/detail?cas_rn=111850-25-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,1,3-Tris(5-cyclohexyl-4-hydroxy-2-methylphenyl)butane', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111850-25-0', 'https://commonchemistry.cas.org/detail?cas_rn=111850-25-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '4,4′,4′′-(1-Methyl-1-propanyl-3-ylidene)tris[2-cyclohexyl-5-methylphenol]', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111850-25-0', 'https://commonchemistry.cas.org/detail?cas_rn=111850-25-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'ADK-ARKLS DH 43', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111850-25-0', 'https://commonchemistry.cas.org/detail?cas_rn=111850-25-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'ARKLS-DH 43', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111850-25-0', 'https://commonchemistry.cas.org/detail?cas_rn=111850-25-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'DH 43', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111850-25-0', 'https://commonchemistry.cas.org/detail?cas_rn=111850-25-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Phenol, 4,4′,4′′-(1-methyl-1-propanyl-3-ylidene)tris[2-cyclohexyl-5-methyl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111850-25-0', 'https://commonchemistry.cas.org/detail?cas_rn=111850-25-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=4,4',4''-(1-methylpropan-1-yl-3-ylidene)tris(2-cyclohexyl-5-methylphenol)||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=111850-25-0; added Common Chemistry CAS names as altLabel: 1,1,3-Tri(3-cyclohexyl-4-hydroxy-6-methylphenyl)butane, 1,1,3-Tris(2-methyl-4-hydroxy-5-cyclohexylphenyl)butane, 1,1,3-Tris(2-methyl-5-cyclohexyl-4-hydroxyphenyl)butane, 1,1,3-Tris(3′-cyclohexyl-4′-hydroxy-6′-methylphenyl)butane, 1,1,3-Tris(5-cyclohexyl-4-hydroxy-2-methylphenyl)butane, 4,4′,4′′-(1-Methyl-1-propanyl-3-ylidene)tris[2-cyclohexyl-5-methylphenol], ADK-ARKLS DH 43, ARKLS-DH 43, DH 43, Phenol, 4,4′,4′′-(1-methyl-1-propanyl-3-ylidene)tris[2-cyclohexyl-5-methyl-; object_uuid=fo-a3963a87a044a1f4
cas_match_labels None {'111850-25-0': 'exactMatch'} group_key=4,4',4''-(1-methylpropan-1-yl-3-ylidene)tris(2-cyclohexyl-5-methylphenol)||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'111850-25-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a3963a87a044a1f4: {'111850-25-0': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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      "characterization_factor": 1.9567e-6
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