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Details

Stereochemistry ACHIRAL
Molecular Formula C6H8N2O3
Molecular Weight 156.1393
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5,5-DIMETHYLBARBITURIC ACID

SMILES

CC1(C)C(=O)NC(=O)NC1=O

InChI

InChIKey=LAOZSCRCYVBSJA-UHFFFAOYSA-N
InChI=1S/C6H8N2O3/c1-6(2)3(9)7-5(11)8-4(6)10/h1-2H3,(H2,7,8,9,10,11)

HIDE SMILES / InChI

Molecular Formula C6H8N2O3
Molecular Weight 156.1393
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Experimental and computational thermochemical study and solid-phase structure of 5,5-dimethylbarbituric acid.
2010-03-18
A comparison of theoretical methods of calculation of partition coefficients for selected drugs.
2010-01-21
Simple, rapid, and highly sensitive detection of diphosgene and triphosgene by spectrophotometric methods.
2009-11-15
Diammonium 1,1',3,3'-tetra-methyl-2,2',4,4',6,6'-hexa-oxoperhydro-5,5'-bipyrimidine-5,5'-diide monohydrate.
2009-10-07
New synthesis, properties, and oxidizing ability of 1,3-dimethyl-5,10-methanocycloundeca[4,5]furo[2,3-d]pyrimidin- 2,4(1,3H)-dionylium tetrafluoroborate.
2004-12-24
Novel synthesis and oxidizing ability of tropylium ions annulated with two 2,4-dimethylfuro[2,3-d]pyrimidine-1(2H),3(4H)-diones.
2004-07-09
Synthesis, properties, and oxidizing ability of 9,11-dimethylbenzocyclohepta[6,7-b]pyrimido[5,4-d]furan- 10(9H),12(11H)-dionylium tetrafluoroborate.
2003-11-28
Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 22:30:46 GMT 2025
Edited
by admin
on Mon Mar 31 22:30:46 GMT 2025
Record UNII
25801SQA9H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,4,6(1H,3H,5H)-PYRIMIDINETRIONE, 5,5-DIMETHYL-
Preferred Name English
5,5-DIMETHYLBARBITURIC ACID
Systematic Name English
NSC-120194
Code English
Code System Code Type Description
EPA CompTox
DTXSID2020509
Created by admin on Mon Mar 31 22:30:46 GMT 2025 , Edited by admin on Mon Mar 31 22:30:46 GMT 2025
PRIMARY
ECHA (EC/EINECS)
246-265-8
Created by admin on Mon Mar 31 22:30:46 GMT 2025 , Edited by admin on Mon Mar 31 22:30:46 GMT 2025
PRIMARY
NSC
120194
Created by admin on Mon Mar 31 22:30:46 GMT 2025 , Edited by admin on Mon Mar 31 22:30:46 GMT 2025
PRIMARY
CAS
24448-94-0
Created by admin on Mon Mar 31 22:30:46 GMT 2025 , Edited by admin on Mon Mar 31 22:30:46 GMT 2025
PRIMARY
PUBCHEM
90509
Created by admin on Mon Mar 31 22:30:46 GMT 2025 , Edited by admin on Mon Mar 31 22:30:46 GMT 2025
PRIMARY
FDA UNII
25801SQA9H
Created by admin on Mon Mar 31 22:30:46 GMT 2025 , Edited by admin on Mon Mar 31 22:30:46 GMT 2025
PRIMARY