5900-45-8
2-[5-CYANO-6-METHYL-2,4-DIOXO-3,4-DIHYDRO-1(2H)-PYRIMIDINYL]ACETIC ACID
Name
2-[5-CYANO-6-METHYL-2,4-DIOXO-3,4-DIHYDRO-1(2H)-PYRIMIDINYL]ACETIC ACID
pro_formula
C8 H7 N3 O4
pro_molWeight
209.16
1Identification
【Name】
2-[5-CYANO-6-METHYL-2,4-DIOXO-3,4-DIHYDRO-1(2H)-PYRIMIDINYL]ACETIC ACID
【CAS】
【MDL】
MFCD09607900
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C8 H7 N3 O4
【pro_molWeight】
209.16
【Inchi】
InChI=1S/C8H7N3O4/c1-4-5(2-9)7(14)10-8(15)11(4)3-6(12)13/h3H2,1H3,(H,12,13)(H,10,14,15)
【InChIKey】
InChIKey=AIONAEISTHAXLB-UHFFFAOYSA-N
【SMILES】
Cc1c(c(=O)[nH]c(=O)n1CC(=O)O)C#N
【MOL File】
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:7
XLogP3:0.0
Bulk/Fine:FB
3MaterialMSDS
4CMLFile
2-[5-CYANO-6-METHYL-2,4-DIOXO-3,4-DIHYDRO-1(2H)-PYRIMIDINYL]ACETIC ACID.cml
quick_release
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Matrix Scientific
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Alfa Chemistry
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