Bis(2-ethylhexyl)octylphosphonate

Bis(2-Ethylhexyl) octanephosphonate
Bis(2-ethylhexyl) P-octylphosphonate
Phosphonic acid, octyl-, bis(2-ethylhexyl) ester
Phosphonic acid, P-octyl-, bis(2-ethylhexyl) ester

Property	Value
InChI2D key string chemrof:inchi2d_key_string	ALVKGSGIVCHADB-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C24H51O3P/c1-6-11-14-15-16-17-20-28(25,26-21-23(9-4)18-12-7-2)27-22-24(10-5)19-13-8-3/h23-24H,6-22H2,1-5H3
IUPAC name chemrof:IUPAC_name	Bis(2-ethylhexyl)octylphosphonate
Molecular formula chemrof:molecular_formula	C24H51O3P
Molecular mass chemrof:molecular_mass	418.643
Monoisotopic mass chemrof:monoisotopic_mass	418.357582
SMILES string chemrof:smiles_string	CCCCCCCCP(=O)(OCC(CC)CCCC)OCC(CC)CCCC

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=52894-02-7	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.111.803	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID701289775	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/19850627	enrich_references.pubchem_compound
wikidata.org	https://www.wikidata.org/wiki/Q126612004	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
230795ee-5714-4996-acc9-d4d9b551c72e	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
d6f40732-46a1-43ad-a17c-0b1cdba98e4c	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
32b4711b-04b5-4fe5-aae7-6de035fee40b	Environmental → Air → Indoor	EF 3.1	kg	2
04c91e91-750c-461c-81e3-35aec552408b	Environmental → Air → Long-term	EF 3.1	kg	0
9e82b69b-d322-4f69-aab6-72da5f241c87	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
c15557b8-1737-40c3-81ea-204b6c44bc3e	Environmental → Air → Unknown	EF 3.1	kg	2
d7ae7366-25c9-45c2-ad86-870f107a1815	Environmental → Ground → Agricultural	EF 3.1	kg	2
0e28376d-e11f-4d5c-b3ec-12a77d984bf5	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
6aeb14c1-3da2-4d2d-826a-fe2b9a6edded	Environmental → Ground → Unknown	EF 3.1	kg	2
fcd28293-20ce-4510-9e95-73a8d4ffab2c	Environmental → Water → Long-term	EF 3.1	kg	0
b25927cf-fe3e-4fe5-8904-a6116a6f6bdf	Environmental → Water → Ocean	EF 3.1	kg	2
48575ea9-9a64-49b5-b843-a413a8f13335	Environmental → Water → Surface water	EF 3.1	kg	2
a8a2624d-383d-44cb-a65b-ffaaa2a4d056	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (55 changes)

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Flow object JSON

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Bis(2-ethylhexyl)octylphosphonate

Identity

Structure

Alternative labels

Properties

Known URLs

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