5,5-dimethylbarbituric Acid

2,4,6(1H,3H,5H)-Pyrimidinetrione, 5,5-dimethyl-
5,5-Dimethyl barbituric acid
5,5-Dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
Barbituric acid, 5,5-dimethyl-

Property	Value
InChI2D key string chemrof:inchi2d_key_string	LAOZSCRCYVBSJA-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C6H8N2O3/c1-6(2)3(9)7-5(11)8-4(6)10/h1-2H3,(H2,7,8,9,10,11)
IUPAC name chemrof:IUPAC_name	5,5-dimethylbarbituric Acid
Molecular formula chemrof:molecular_formula	C6H8N2O3
Molecular mass chemrof:molecular_mass	156.141
Monoisotopic mass chemrof:monoisotopic_mass	156.053492
SMILES string chemrof:smiles_string	CC1(C)C(=O)NC(=O)NC1=O

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=24448-94-0	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.042.044	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID2020509	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=120194	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL15771	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/25801SQA9H	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J287.258G	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/90509	enrich_references.pubchem_compound
wikidata.org	https://www.wikidata.org/wiki/Q27253930	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit
11fbdb96-d26c-4f83-ae98-e8c7d5bc8d6f	Environmental → Air → Aircraft cruise height	EF 3.1	kg
2ecc41d8-baaa-487b-963c-566c8787fc26	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg
21d36981-c2ba-4b31-ab3d-44c973fedfd2	Environmental → Air → Indoor	EF 3.1	kg
8da27962-6cc2-405b-9fc2-0d36c3c2e6e3	Environmental → Air → Long-term	EF 3.1	kg
851d4a13-9e44-45b0-96b4-c9fad3f84083	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg
05e9edf4-03af-4f80-be80-9541042c90b2	Environmental → Air → Unknown	EF 3.1	kg
ed560410-1b29-43b9-af71-7184125e846b	Environmental → Ground → Agricultural	EF 3.1	kg
530b31d4-5cff-44c3-84ba-2d28da8cde43	Environmental → Ground → Non-agricultural	EF 3.1	kg
371f0bee-dc7d-4d5a-8150-fac679634439	Environmental → Ground → Unknown	EF 3.1	kg
9b7443b5-c6b4-4ab0-a7da-38bc9f66ebb2	Environmental → Water → Long-term	EF 3.1	kg
b5b4bc93-afc9-4d31-9867-8b652f350d01	Environmental → Water → Ocean	EF 3.1	kg
df40421f-46a5-4d35-ae60-8c789ce3a80a	Environmental → Water → Surface water	EF 3.1	kg
b40ebaac-23c4-4efe-b400-a4b4b414a6d6	Environmental → Water → Unknown	EF 3.1	kg

Everything that changed this substance (55 changes)

Open the changes page

Flow object JSON

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5,5-dimethylbarbituric Acid

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Structure

Alternative labels

Properties

Known URLs

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