2-methylpropane-2-thiol

1,1-Dimethylethanethiol
2-Isobutanethiol
2-Methyl-2-propanethiol
2-Propanethiol, 2-methyl-
t-Butanethiol
t-Butylmercaptan
t-Butylthiol
TBM
tert-Butanethiol
tert-Butyl mercaptan
tert-Butylthiol

Property	Value
InChI2D key string chemrof:inchi2d_key_string	WMXCDAVJEZZYLT-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C4H10S/c1-4(2,3)5/h5H,1-3H3
IUPAC name chemrof:IUPAC_name	2-methylpropane-2-thiol
Molecular formula chemrof:molecular_formula	C4H10S
Molecular mass chemrof:molecular_mass	90.191
Monoisotopic mass chemrof:monoisotopic_mass	90.050321
SMILES string chemrof:smiles_string	CC(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=75-66-1	enrich_references.consensus_cas_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.000.810	enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org	https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0019	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID0026418	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=229569	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3182458	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/489PW92WIV	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J4.161K	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/6387	enrich_references.pubchem_compound
PubChem	https://pubchem.ncbi.nlm.nih.gov/erg/#2347	enrich_references.pubchem_identifier_url
Wikidata	https://www.wikidata.org/wiki/Q973473	enrich_references.pubchem_identifier_url
Wikipedia	https://en.wikipedia.org/wiki/Tert-Butylthiol	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
82a16739-850c-4efc-941b-db15d1e44f35	Environmental → Air → Aircraft cruise height	EF 3.1	kg	4
0ff85a0f-5ceb-4965-b45a-d21d834fc656	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	4
dc5cfe53-8c64-40ed-a98c-4e8a29d5a2f1	Environmental → Air → Indoor	EF 3.1	kg	4
0299ed7c-0bb9-45e0-bde8-16fafdf8de62	Environmental → Air → Long-term	EF 3.1	kg	0
d5c445d3-3120-4caa-9133-a282754965db	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	4
58c5cb94-429b-4e6c-bbfb-c08e16fc5691	Environmental → Air → Unknown	EF 3.1	kg	4
c93cd22d-8bc8-470f-ac6d-980762fcda7c	Environmental → Ground → Agricultural	EF 3.1	kg	4
a9ecb512-a23d-47d4-99e8-64eb16851eb1	Environmental → Ground → Non-agricultural	EF 3.1	kg	4
093216ae-b3c5-45ad-b568-44fa93193ab4	Environmental → Ground → Unknown	EF 3.1	kg	4
b17e0dc9-8d23-483a-b153-b31a9811b1d3	Environmental → Water → Long-term	EF 3.1	kg	0
6943168b-9fc7-466e-b76d-6fe23221833b	Environmental → Water → Ocean	EF 3.1	kg	4
1a093d99-0721-4717-8ea2-fbe5747cf03b	Environmental → Water → Surface water	EF 3.1	kg	4
91b64911-5553-4d65-aa0f-abe690d8608f	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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        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "brightway-flows",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "ec_numbers"
      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ]
}

You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works

2-methylpropane-2-thiol

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

Full record

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