Reaction Products Of Neodecanoic Acid (or Neodecanoyl Chloride Derived From Neodecanoic Acid) And 1,1,3,3-tetramethylbutyl Hydroperoxide

1,1,3,3-Tetramethylbutyl perneodecanoate
1,1,3,3-Tetramethylbutyl peroxyneodecanoate
2,4,4-Trimethylpentyl-2-peroxy neodecanoate
Neodecaneperoxoic acid, 1,1,3,3-tetramethylbutyl ester
Perocta ND
tert-Octyl peroxyneodecanoate
Trigonox 151C70
Trigonox 151W50
Trigonox 423C70

Property	Value
InChI2D key string chemrof:inchi2d_key_string	CRJIYMRJTJWVLU-UHFFFAOYSA-N, NWGNVAMBNXCDMP-UHFFFAOYSA-N, XTJYGTVCDMNODS-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C18H36O3/c1-16(2,3)13-11-9-10-12-15(19)20-21-18(7,8)14-17(4,5)6/h9-14H2,1-8H3
IUPAC name chemrof:IUPAC_name	1,1,3,3-Tetramethylbutyl peroxyneodecanoate
Molecular formula chemrof:molecular_formula	C18H34O4, C18H36O3
SMILES string chemrof:smiles_string	CC(C)(C)CCCCCC(=O)OOC(C)(C)CC(C)(C)C

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=51240-95-0	enrich_references.consensus_cas_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.051.871	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID20933604	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID90965533	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/6452377	enrich_references.pubchem_compound
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/73557412	enrich_references.pubchem_compound
Wikidata	https://www.wikidata.org/wiki/Q82909434	enrich_references.pubchem_identifier_url
Wikidata	https://www.wikidata.org/wiki/Q82947771	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
a55158d2-71b5-4faf-9962-27d3794238bc	Environmental → Air → Aircraft cruise height	EF 3.1	kg	4
c1405a2c-2ca8-436d-a625-423aed841900	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	4
d3cf5d3a-327e-471a-9624-9eb87000d4dd	Environmental → Air → Indoor	EF 3.1	kg	4
d9fb4591-fd6a-4cbe-85e8-5abc6d9877d6	Environmental → Air → Long-term	EF 3.1	kg	0
695050fe-db1f-47e1-bba3-5c5fc8f127bb	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	4
abe0fe71-99d8-4d64-ba3e-f74bbfe74735	Environmental → Air → Unknown	EF 3.1	kg	4
a8576a06-d3c7-4957-8ecb-af11e6ad06ee	Environmental → Ground → Agricultural	EF 3.1	kg	4
7de56dd6-bd02-4777-9225-77cfa8c26e96	Environmental → Ground → Non-agricultural	EF 3.1	kg	4
579b4de9-be02-4f8f-87ba-c2676696cdf2	Environmental → Ground → Unknown	EF 3.1	kg	4
ab8e02e4-73cf-4c96-97f8-1b7274533d82	Environmental → Water → Long-term	EF 3.1	kg	0
21982dba-1b99-4c83-a0c7-52f9ee444a7a	Environmental → Water → Ocean	EF 3.1	kg	4
ed0783cf-4faf-4cf1-88c3-71fba53bec01	Environmental → Water → Surface water	EF 3.1	kg	4
8c07a17c-4a2e-48cf-bedf-9b4632b7f966	Environmental → Water → Unknown	EF 3.1	kg	4

Everything that changed this substance (55 changes)

Open the changes page

Flow object JSON

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Reaction Products Of Neodecanoic Acid (or Neodecanoyl Chloride Derived From Neodecanoic Acid) And 1,1,3,3-tetramethylbutyl Hydroperoxide

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

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