1,1-dimethyl-2-thiourea

1,1-Dimethylthiourea
Urea, 1,1-dimethyl-2-thio-

Property	Value
InChI2D key string chemrof:inchi2d_key_string	ZQGWBPQBZHMUFG-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C3H8N2S/c1-5(2)3(4)6/h1-2H3,(H2,4,6)
IUPAC name chemrof:IUPAC_name	1,1-dimethyl-2-thiourea
Molecular formula chemrof:molecular_formula	C3H8N2S
Molecular mass chemrof:molecular_mass	104.178
Monoisotopic mass chemrof:monoisotopic_mass	104.040819
SMILES string chemrof:smiles_string	CN(C)C(N)=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=6972-05-0	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.027.459	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID80220007	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=67246	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/E9F6NSU1N5	enrich_references.pubchem_identifier_url
HMDB	https://hmdb.ca/metabolites/HMDB0255268	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J8.870F	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/3034192	enrich_references.pubchem_compound
Wikidata	https://www.wikidata.org/wiki/Q83097071	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
da128ffa-8f8b-4dd5-93b1-0cdf1eac15f4	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
bb527aab-ee09-4d14-ba89-970cd37c17f3	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
7ee82762-d2c8-409f-9cb3-b0cd89d076ef	Environmental → Air → Indoor	EF 3.1	kg	2
726e9d9f-a7a9-4a07-b03f-c7a81cbf7f40	Environmental → Air → Long-term	EF 3.1	kg	0
b6e32d4d-622b-41d7-8373-9fbc2d445ecd	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
629b61fb-d12d-4271-8ca2-fc68d310dfa9	Environmental → Air → Unknown	EF 3.1	kg	2
1c1bbf03-8cda-4cab-872e-5995bf7ec030	Environmental → Ground → Agricultural	EF 3.1	kg	2
9f76f837-f3d8-4461-ae24-19a1cc2ac9aa	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
fad57887-c0dc-4fc2-a4b0-66fc9bb57c40	Environmental → Ground → Unknown	EF 3.1	kg	2
d7b8867d-c93a-45c0-82a9-1272c3d16f7f	Environmental → Water → Long-term	EF 3.1	kg	0
7f07e5cc-b431-42b8-9f4f-268362ceb183	Environmental → Water → Ocean	EF 3.1	kg	2
f1390628-3322-4867-83c0-2c371bffc74b	Environmental → Water → Surface water	EF 3.1	kg	2
c64174d8-8a2d-4a2a-8862-21b80434809c	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (55 changes)

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Flow object JSON

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}

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1,1-dimethyl-2-thiourea

Identity

Structure

Alternative labels

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