2-methyloctane-2-thiol

Sulfole 90
tert-Nonanethiol
tert-Nonyl mercaptan

Property	Value
InChI2D key string chemrof:inchi2d_key_string	GIHYOCFYKBPKKF-UHFFFAOYSA-N, MPBLPZLNKKGCGP-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C9H20S/c1-4-5-6-7-8-9(2,3)10/h10H,4-8H2,1-3H3
IUPAC name chemrof:IUPAC_name	2-methyloctane-2-thiol
Molecular formula chemrof:molecular_formula	C9H20S
SMILES string chemrof:smiles_string	CCCCCCC(C)(C)S

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=25360-10-5	enrich_references.consensus_cas_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.042.619	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID40274046	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1870953	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/168S427F21	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.918.722C	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/106220	enrich_references.pubchem_compound
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/520196	enrich_references.pubchem_compound
Wikidata	https://www.wikidata.org/wiki/Q27251793	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
ff0786d7-0605-4305-a0f7-b5c7a668d007	Environmental → Air → Aircraft cruise height	EF 3.1	kg	4
3ec456cb-e7a9-4cd8-a4d1-9c9c5bee8108	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	4
252ccc38-bbc7-478e-a179-2b41c564ce9a	Environmental → Air → Indoor	EF 3.1	kg	4
292e601a-e2e3-4623-94b3-5df4d75271c4	Environmental → Air → Long-term	EF 3.1	kg	0
557c3cd0-71ff-4454-ab9c-1ecc74ff15e7	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	4
a47e80be-033e-4683-b54a-8f410e7d02fb	Environmental → Air → Unknown	EF 3.1	kg	4
90de5c57-4953-4cb5-a518-2e9eda2b29fe	Environmental → Ground → Agricultural	EF 3.1	kg	4
6cf2fc07-84ce-43ed-a0f4-ff07c2249903	Environmental → Ground → Non-agricultural	EF 3.1	kg	4
47514819-579a-45c0-b2dc-9d7d1ed25c16	Environmental → Ground → Unknown	EF 3.1	kg	4
19142ba5-4944-427b-8576-793f09b3a78d	Environmental → Water → Long-term	EF 3.1	kg	0
842cdec6-4b0d-4f8b-8ccc-b2744d3b2ca6	Environmental → Water → Ocean	EF 3.1	kg	4
3a8c1fef-03c8-4766-b785-3fab1bf128dd	Environmental → Water → Surface water	EF 3.1	kg	4
51705789-d589-48b3-9b0d-5e68f5a2b57e	Environmental → Water → Unknown	EF 3.1	kg	4

Everything that changed this substance (54 changes)

Open the changes page

Flow object JSON

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2-methyloctane-2-thiol

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

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