Fatty Acids, C16-18 (even Numbered), Branched And Linear, Triesters With Trimethylolpropane

Crodamol TTIS
Isooctadecanoic acid, 1,1′-[2-ethyl-2-[[(1-oxoisooctadecyl)oxy]methyl]-1,3-propanediyl] ester
Isooctadecanoic acid, 2-ethyl-2-[[(1-oxoisooctadecyl)oxy]methyl]-1,3-propanediyl ester
KAK-TTI
Pelemol TMPIS
RA-TM 318
Trimethylolpropane triisooctadecanoate
Trimethylolpropane triisostearate

Property	Value
InChI2D key string chemrof:inchi2d_key_string	PHMFOWQZOHAHQY-UHFFFAOYSA-N, RKJGFHYCZPZJPE-UHFFFAOYSA-N, XKBGOZUEVBYOMF-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/3C18H36O2.C6H14O3/c31-17(2)15-13-11-9-7-5-3-4-6-8-10-12-14-16-18(19)20;1-2-6(3-7,4-8)5-9/h317H,3-16H2,1-2H3,(H,19,20);7-9H,2-5H2,1H3
IUPAC name chemrof:IUPAC_name	Trimethylolpropane triisooctadecanoate
Molecular formula chemrof:molecular_formula	C60H116O6, C60H122O9, C79H152O6
SMILES string chemrof:smiles_string	CC(C)CCCCCCCCCCCCCCC(=O)O.CC(C)CCCCCCCCCCCCCCC(=O)O.CC(C)CCCCCCCCCCCCCCC(=O)O.CCC(CO)(CO)CO

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=68541-50-4	enrich_references.consensus_cas_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.064.841	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID8071645	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/Y32A6D7C6L	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J332.494J	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/102600833	enrich_references.pubchem_compound
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/110529	enrich_references.pubchem_compound
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/18466391	enrich_references.pubchem_compound
Wikidata	https://www.wikidata.org/wiki/Q27294200	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
428d8cf3-5e74-4bc9-a929-5348c0ed75b7	Environmental → Air → Aircraft cruise height	EF 3.1	kg	4
83a5a9d5-b788-457c-8278-e68a6e338cb4	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	4
79726acb-ffe7-4775-afe2-03dea503cd5a	Environmental → Air → Indoor	EF 3.1	kg	4
55d249d6-d8ef-4eca-b3da-789c783a5c0a	Environmental → Air → Long-term	EF 3.1	kg	0
62fe27bb-d91d-4c07-befb-375f6ea392ca	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	4
7378553c-2bdf-44c9-8e08-817fe8e135a0	Environmental → Air → Unknown	EF 3.1	kg	4
bf363540-43b6-4a07-a63f-97d3e48ff0a7	Environmental → Ground → Agricultural	EF 3.1	kg	4
a33128af-0a71-4bd2-92d5-53070aa0d714	Environmental → Ground → Non-agricultural	EF 3.1	kg	4
4b8649fd-71dd-425f-9c1b-de298388bfe7	Environmental → Ground → Unknown	EF 3.1	kg	4
8dff595a-0e53-47e2-ae55-5a378fbdbb4c	Environmental → Water → Long-term	EF 3.1	kg	0
4ddf46b3-a457-4cc0-a4c4-343316315c6a	Environmental → Water → Ocean	EF 3.1	kg	4
a2bbd576-ab0c-403c-aaf9-92cf4e0f0f5f	Environmental → Water → Surface water	EF 3.1	kg	4
2ea472bb-5297-4a36-95ea-2685b27c90c0	Environmental → Water → Unknown	EF 3.1	kg	4

Everything that changed this substance (56 changes)

Open the changes page

Flow object JSON

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Fatty Acids, C16-18 (even Numbered), Branched And Linear, Triesters With Trimethylolpropane

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

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