Thiophenol

Benzenethiol
mercaptobenzene
Phenol, thio-
Phenyl hydrosulfide
phenyl mercaptan
Phenylmercaptane
Phenylthiol

Property	Value
Elemental charge chemrof:elemental_charge	0
InChI2D key string chemrof:inchi2d_key_string	RMVRSNDYEFQCLF-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C6H6S/c7-6-4-2-1-3-5-6/h1-5,7H
IUPAC name chemrof:IUPAC_name	Thiophenol
Molecular formula chemrof:molecular_formula	C6H6S
Molecular mass chemrof:molecular_mass	110.181
Monoisotopic mass chemrof:monoisotopic_mass	110.01902, 110.019021
SMILES string chemrof:smiles_string	Sc1ccccc1

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=108-98-5	enrich_references.chebi_xrefs
CAS Common Chemistry	https://commonchemistry.cas.org/detail?cas_rn=33411-63-1	enrich_references.pubchem_identifier_url
cdc.gov	https://www.cdc.gov/niosh-rtecs/DC802C8.html	enrich_references.pubchem_identifier_url
ChEBI	https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:48498	enrich_references.chebi_id_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.003.306	enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org	https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0463	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID7026811	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=229566	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=6953	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL119405	enrich_references.pubchem_identifier_url
femaflavor.org	https://www.femaflavor.org/flavor-library/benzenethiol	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/7K011JR4T0	enrich_references.pubchem_identifier_url
HMDB	https://hmdb.ca/metabolites/HMDB0033746	enrich_references.chebi_xrefs
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.874F	enrich_references.pubchem_identifier_url
metabolomicsworkbench.org	https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=46184	enrich_references.pubchem_identifier_url
MetaCyc	https://metacyc.org/compound?orgid=META&id=CPD-8132	enrich_references.chebi_xrefs
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/7969	enrich_references.pubchem_compound
PubChem	https://pubchem.ncbi.nlm.nih.gov/erg/#2337	enrich_references.pubchem_identifier_url
PubMed	https://pubmed.ncbi.nlm.nih.gov/23902004	enrich_references.chebi_xrefs
PubMed	https://pubmed.ncbi.nlm.nih.gov/23961762	enrich_references.chebi_xrefs
reaxys	reaxys:506523	enrich_references.chebi_xrefs
Wikidata	https://www.wikidata.org/wiki/Q338965	enrich_references.pubchem_identifier_url
Wikipedia	https://en.wikipedia.org/wiki/Thiophenol	enrich_references.chebi_xrefs

Flow	Context	Source	Unit	CFs
734b2ba5-d68b-4904-899e-1c37eea29b3f	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
d8190dfd-1544-4433-a41a-a307711ce87a	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
2bbd4b94-60e6-4a3b-9069-6627822760bf	Environmental → Air → Indoor	EF 3.1	kg	2
258a407f-1246-429f-a757-2a164f60a805	Environmental → Air → Long-term	EF 3.1	kg	0
8fc7ba9d-7601-42f3-a9b9-9e7b70787fab	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
def125bf-0992-4902-b3f6-899ed0224e63	Environmental → Air → Unknown	EF 3.1	kg	2
60bed7fa-a6d2-4388-b5b6-ba81b5b5394f	Environmental → Ground → Agricultural	EF 3.1	kg	2
4b016459-aa82-44b3-89e5-1ab06c31548c	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
bac02569-7172-40aa-aeec-87694757559a	Environmental → Ground → Unknown	EF 3.1	kg	2
7dc81f77-7598-427e-8d2b-669f1f803ed8	Environmental → Water → Long-term	EF 3.1	kg	0
1b6912b5-573b-4374-9736-8af7c856ade3	Environmental → Water → Ocean	EF 3.1	kg	2
c69486b3-dcc7-42a5-b7e7-71c31a8c1cb0	Environmental → Water → Surface water	EF 3.1	kg	2
47e13f22-43fc-4718-a276-ad8250c248ef	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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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

Thiophenol

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

Full record

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