Benzo[b]thiophene

1-benzothiophene
1-thiaindene
2,3-Benzothiophene
benzothiofuran
Benzothiophen
Benzothiophene
Thianaphthen
thianaphthene
Thionaphthene

Property	Value
Elemental charge chemrof:elemental_charge	0
InChI2D key string chemrof:inchi2d_key_string	FCEHBMOGCRZNNI-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C8H6S/c1-2-4-8-7(3-1)5-6-9-8/h1-6H
IUPAC name chemrof:IUPAC_name	Benzo[b]thiophene
Molecular formula chemrof:molecular_formula	C8H6S
Molecular mass chemrof:molecular_mass	134.203
Monoisotopic mass chemrof:monoisotopic_mass	134.01902, 134.019021
SMILES string chemrof:smiles_string	c1ccc2sccc2c1

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
beilstein	beilstein:80580	enrich_references.chebi_xrefs
CAS Common Chemistry	https://commonchemistry.cas.org/detail?cas_rn=30281-16-4	enrich_references.pubchem_identifier_url
CAS Common Chemistry	https://commonchemistry.cas.org/detail?cas_rn=95-15-8	enrich_references.chebi_xrefs
ChEBI	https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:35858	enrich_references.chebi_id_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.002.178	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID2052736	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=47196	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL87112	enrich_references.pubchem_identifier_url
gmelin	gmelin:142782	enrich_references.chebi_xrefs
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/073790YQ2G	enrich_references.pubchem_identifier_url
HMDB	https://hmdb.ca/metabolites/HMDB0249003	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J4.710D	enrich_references.pubchem_identifier_url
metabolomicsworkbench.org	https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=55217	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/7221	enrich_references.pubchem_compound
wikidata.org	https://www.wikidata.org/wiki/Q419709	enrich_references.pubchem_identifier_url
Wikipedia	https://en.wikipedia.org/wiki/Benzothiophene	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
c3a7cc9d-4995-4615-b273-d49451a3223e	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
3ed3c391-29ae-4398-ab7f-f878fa629f76	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
1429e508-8f07-4882-bb6f-640ce09fc1c8	Environmental → Air → Indoor	EF 3.1	kg	2
580d01f9-a133-4b50-8fef-c150b63faabb	Environmental → Air → Long-term	EF 3.1	kg	0
511b14d1-94b4-4801-90fe-651537718bd8	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
c3c40251-653d-4e03-bdd1-430210c0fab6	Environmental → Air → Unknown	EF 3.1	kg	2
d01179a8-a94b-4a94-91d6-63379eb8d473	Environmental → Ground → Agricultural	EF 3.1	kg	2
204b8243-8059-495c-92e2-7ac90dc0fa32	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
19d4b3c5-08d2-46bd-b871-a2cee0097468	Environmental → Ground → Unknown	EF 3.1	kg	2
bb3e6f2a-6749-451f-b25b-1219a8df05f6	Environmental → Water → Long-term	EF 3.1	kg	0
667d6962-342b-4e6c-903a-2d968aa445ea	Environmental → Water → Ocean	EF 3.1	kg	2
2c75c2f3-54cc-41e4-942f-c584c790c186	Environmental → Water → Surface water	EF 3.1	kg	2
0dda1845-39ec-4c17-a279-bfa177be48bb	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (57 changes)

Open the changes page

Flow object JSON

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Benzo[b]thiophene

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

Full record

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