Propanoic Acid, 3,3' [(dibutylstannylene) Bis(thio)]bis-, Diisotridecylester

Propanoic acid, 3,3′-[(dibutylstannylene)bis(thio)]bis-, 1,1′-diisotridecyl ester
Propanoic acid, 3,3′-[(dibutylstannylene)bis(thio)]bis-, diisotridecyl ester

Property	Value
InChI2D key string chemrof:inchi2d_key_string	ZVPIONMDWKYASL-UHFFFAOYSA-L
InChI2D string chemrof:inchi2d_string	InChI=1S/2C16H32O2S.2C4H9.Sn/c21-15(2)11-9-7-5-3-4-6-8-10-13-18-16(17)12-14-19;21-3-4-2;/h215,19H,3-14H2,1-2H3;21,3-4H2,2H3;/q;;;;+2/p-2
IUPAC name chemrof:IUPAC_name	Propanoic acid, 3,3′-[(dibutylstannylene)bis(thio)]bis-, 1,1′-diisotridecyl ester
Molecular formula chemrof:molecular_formula	C40H80O4S2Sn
Molecular mass chemrof:molecular_mass	807.921
Monoisotopic mass chemrof:monoisotopic_mass	808.451998
SMILES string chemrof:smiles_string	CCC[CH2][Sn]([CH2]CCC)([S]CCC(=O)OCCCCCCCCCCC(C)C)[S]CCC(=O)OCCCCCCCCCCC(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=84896-44-6	enrich_references.consensus_cas_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.076.755	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID7074113	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/9577822	enrich_references.pubchem_compound
wikidata.org	https://www.wikidata.org/wiki/Q82002622	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
3a415200-1c5f-49c3-b26c-3c1b2aef1962	Environmental → Air → Aircraft cruise height	EF 3.1	kg	4
3cfd8a00-3444-486b-899b-9bcd0ac80ab3	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	4
c3d227ec-a024-433d-b52e-0b6c9ef74327	Environmental → Air → Indoor	EF 3.1	kg	4
789d2e88-5290-4991-bef1-760819901eb4	Environmental → Air → Long-term	EF 3.1	kg	0
ec5178e8-6b63-4a46-a669-6e16ede6302e	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	4
516a994d-a5bd-4302-9b04-983e746fc965	Environmental → Air → Unknown	EF 3.1	kg	4
f2da0a79-8e29-4eba-a268-366081efb0f3	Environmental → Ground → Agricultural	EF 3.1	kg	4
18ec91c9-863d-4efd-baa0-e23cc29437c9	Environmental → Ground → Non-agricultural	EF 3.1	kg	4
ab425594-a189-4afc-8281-d27822f586aa	Environmental → Ground → Unknown	EF 3.1	kg	4
3976515d-b6af-460a-9dea-1d1675c6bdb3	Environmental → Water → Long-term	EF 3.1	kg	0
9ad07d84-0e0c-4792-a071-f45e4d9e551e	Environmental → Water → Ocean	EF 3.1	kg	4
cc297127-70df-453d-9ff9-478ba46e4282	Environmental → Water → Surface water	EF 3.1	kg	4
5d95ae85-b985-461c-acf2-4d8a814958be	Environmental → Water → Unknown	EF 3.1	kg	4

Everything that changed this substance (54 changes)

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Flow object JSON

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Propanoic Acid, 3,3' [(dibutylstannylene) Bis(thio)]bis-, Diisotridecylester

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

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