Di-tert-butyl Sulphide

2,2,4,4-Tetramethyl-3-thiapentane
2,2′-Thiobis[2-methylpropane]
2-(tert-Butylsulfanyl)-2-methylpropane
2-tert-Butylsulfanyl-2-methylpropane
Bis(1,1-dimethylethyl) sulfide
Bis(tert-butyl) sulfide
Di-tert-butyl sulfide
Propane, 2,2′-thiobis[2-methyl-
tert-Butyl sulfide

Property	Value
InChI2D key string chemrof:inchi2d_key_string	LNMBCRKRCIMQLW-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C8H18S/c1-7(2,3)9-8(4,5)6/h1-6H3
IUPAC name chemrof:IUPAC_name	Di-tert-butyl Sulphide
Molecular formula chemrof:molecular_formula	C8H18S
Molecular mass chemrof:molecular_mass	146.299
Monoisotopic mass chemrof:monoisotopic_mass	146.112922
SMILES string chemrof:smiles_string	CC(C)(C)SC(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=107-47-1	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.003.177	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID5021887	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=4549	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/U27L6HX2MW	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J114.114G	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/7872	enrich_references.pubchem_compound
Wikidata	https://www.wikidata.org/wiki/Q63409482	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
d468121f-4001-456b-a3f2-29c7388cd532	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
b9233987-3489-4cff-a7fb-b0352944185a	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
0bef6727-fe2a-4ef0-9969-51946746799c	Environmental → Air → Indoor	EF 3.1	kg	2
18a76c66-b6fd-43da-88ca-7d8c02090ad2	Environmental → Air → Long-term	EF 3.1	kg	0
6ae46ebb-8eaa-46d6-a682-9cc0081fde06	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
e1782b0c-d325-481b-a4bf-079d82fed502	Environmental → Air → Unknown	EF 3.1	kg	2
15eba3cc-bbfc-490b-b8e0-11d6cf51d880	Environmental → Ground → Agricultural	EF 3.1	kg	2
69934e46-3318-483d-935d-fe7656cc9395	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
d37557a4-e077-4736-b1c7-9594187de625	Environmental → Ground → Unknown	EF 3.1	kg	2
c6a81c8d-9b4e-4f04-8fd7-04d80402535f	Environmental → Water → Long-term	EF 3.1	kg	0
a6a84b46-cd0c-4b79-a77d-9d98a523c2e8	Environmental → Water → Ocean	EF 3.1	kg	2
26098664-16af-4164-a93c-d2e2b0f46c75	Environmental → Water → Surface water	EF 3.1	kg	2
6599971b-773e-4764-9d19-38a22809c69f	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (56 changes)

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Flow object JSON

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Di-tert-butyl Sulphide

Identity

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Elementary flows

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