Butanethiol

1-Butanethiol
1-Butyl mercaptan
1-Mercaptobutane
Butane-1-thiol
Butyl mercaptan
Butylmercaptane
Butylthiol
n-Butane-1-thiol
n-Butanethiol
n-Butyl mercaptan
n-Butyl thioalcohol
n-Butylthiol
Thiobutyl alcohol

Property	Value
Elemental charge chemrof:elemental_charge	0
InChI2D key string chemrof:inchi2d_key_string	WQAQPCDUOCURKW-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C4H10S/c1-2-3-4-5/h5H,2-4H2,1H3
IUPAC name chemrof:IUPAC_name	Butanethiol
Molecular formula chemrof:molecular_formula	C4H10S
Molecular mass chemrof:molecular_mass	90.191
Monoisotopic mass chemrof:monoisotopic_mass	90.05032, 90.050321
SMILES string chemrof:smiles_string	CCCCS

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=109-79-5	enrich_references.chebi_xrefs
cdc.gov	https://www.cdc.gov/niosh-rtecs/EK602160.html	enrich_references.pubchem_identifier_url
ChEBI	https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:177389	enrich_references.chebi_id_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.003.370	enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org	https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0018	enrich_references.pubchem_identifier_url
ChemSpider	https://www.chemspider.com/Chemical-Structure.7721.html	enrich_references.chebi_xrefs
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID6026824	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3188256	enrich_references.pubchem_identifier_url
femaflavor.org	https://www.femaflavor.org/flavor-library/1-butanethiol	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/77OY909F30	enrich_references.pubchem_identifier_url
HMDB	https://hmdb.ca/metabolites/HMDB0031322	enrich_references.chebi_xrefs
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.970D	enrich_references.pubchem_identifier_url
metabolomicsworkbench.org	https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=44818	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/8012	enrich_references.pubchem_compound
PubChem	https://pubchem.ncbi.nlm.nih.gov/erg/#2347	enrich_references.pubchem_identifier_url
Wikidata	https://www.wikidata.org/wiki/Q195823	enrich_references.pubchem_identifier_url
Wikipedia	https://en.wikipedia.org/wiki/Butane-1-thiol	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
0ec1ec0d-5722-4885-a47e-4c25276a43e2	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
19ecedd5-a1e0-4ca2-ab35-9d278e960e0d	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
ca658141-479d-43b1-8559-0180371322a4	Environmental → Air → Indoor	EF 3.1	kg	2
620b19e8-f1b6-4d58-a370-0b3e63e967b5	Environmental → Air → Long-term	EF 3.1	kg	0
999b8a28-888e-4db1-a66e-c7d12d636cdb	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
e1bcb8ef-7ac0-4f3d-b75e-f324a2e60b32	Environmental → Air → Unknown	EF 3.1	kg	2
2614e123-9fb9-4252-8f44-fb5327386830	Environmental → Ground → Agricultural	EF 3.1	kg	2
5066f3f6-684b-407e-b3df-d9877eabdc82	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
83b3e225576b6b2c39a35edf56f9b223b4e4e0ee	Environmental → Ground → Silvicultural	ecoinvent algorithm addition	kg	0
4ecaa220-ef38-44fa-bf8b-a4f4feedd5cc	Environmental → Ground → Unknown	EF 3.1	kg	2
02934fe1-c47b-4d71-be6b-0b473cd4025f	Environmental → Water → Long-term	EF 3.1	kg	0
7d91f0a2-5222-476c-b7a7-05de001fc04b	Environmental → Water → Ocean	EF 3.1	kg	2
96a96857-15b4-4b98-8b0a-ec754e63ebbc	Environmental → Water → Surface water	EF 3.1	kg	2
13c881dc-f1b3-4985-90ae-0a0e4e94ac89	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (58 changes)

Open the changes page

Flow object JSON

{
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      "@value": "Butanethiol",
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    {
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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

Butanethiol

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

Full record

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