Consensus flow list

4,4',4''-butane-1,1,3-triyltris(2-tert-butyl-5-methylphenol)

fo-9a318783855601ac

Identity

Type
Neutral molecule
CAS
1843-03-4
EC
217-420-7
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 4,4',4''-butane-1,1,3-triyltris(2-tert-butyl-5-methylphenol)

Alternative labels

28

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string PRWJPWSKLXYEPD-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C37H52O3/c1-21(25-18-29(35(5,6)7)32(38)15-22(25)2)14-28(26-19-30(36(8,9)10)33(39)16-23(26)3)27-20-31(37(11,12)13)34(40)17-24(27)4/h15-21,28,38-40H,14H2,1-13H3
IUPAC name chemrof:IUPAC_name 4,4',4''-butane-1,1,3-triyltris(2-tert-butyl-5-methylphenol)
Molecular formula chemrof:molecular_formula C37H52O3
Molecular mass chemrof:molecular_mass 544.82
Monoisotopic mass chemrof:monoisotopic_mass 544.391646
SMILES string chemrof:smiles_string Cc1cc(O)c(C(C)(C)C)cc1C(C)CC(c1cc(C(C)(C)C)c(O)cc1C)c1cc(C(C)(C)C)c(O)cc1C

Known URLs

7

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource URL Recorded by
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=1843-03-4 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.015.837 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID0038883 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/BF6E9O0XJN enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J47.628E enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/92905 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27274633 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
66da73d4-7574-4fa4-b9f7-6726fc0139f4 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
fbbddb70-6e27-463a-9967-8eb43f363959 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
b4cbca0d-bca4-4668-88e2-0c0bf7f360d2 Environmental → Air → Indoor EF 3.1 kg 2
f8af35df-9faf-4e9c-bd03-16a64ae226e6 Environmental → Air → Long-term EF 3.1 kg 0
bceab45a-4809-4644-a9f6-562fdbba59a4 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
ca23163d-f4d5-4c53-b90b-1c961eb4b376 Environmental → Air → Unknown EF 3.1 kg 2
51b9d6ff-94c7-4951-8acd-693a9c9e0efc Environmental → Ground → Agricultural EF 3.1 kg 2
90cb478c-bcbd-4c9a-a0ee-f59741b2e022 Environmental → Ground → Non-agricultural EF 3.1 kg 2
e31c1a37-a177-41ea-b55f-118b6a1b2ed7 Environmental → Ground → Unknown EF 3.1 kg 2
bdfa0860-2190-4ae7-b6d4-b15e459da80e Environmental → Water → Long-term EF 3.1 kg 0
d52615e7-3557-4b77-acfc-190240c6308a Environmental → Water → Ocean EF 3.1 kg 2
0d51d95c-baf5-4c46-8a3f-e379fcc64a10 Environmental → Water → Surface water EF 3.1 kg 2
08868780-4eb2-476b-97d3-841f69b51bed Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON 
{
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}

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