526212-02-2
1H-IMIDAZOLE-1-CARBONITRILE,2,3-DIHYDRO-4,5-DIMETHYL-2-OXO-
Name1H-IMIDAZOLE-1-CARBONITRILE,2,3-DIHYDRO-4,5-DIMETHYL-2-OXO-
1Identification
【Name】
1H-IMIDAZOLE-1-CARBONITRILE,2,3-DIHYDRO-4,5-DIMETHYL-2-OXO-
【CAS】
【MDL】
MFCD18808473
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C6 H7 N3 O
【pro_molWeight】
137.141
【Inchi】
InChI=1S/C6H7N3O/c1-4-5(2)9(3-7)6(10)8-4/h1-2H3,(H,8,10)
【InChIKey】
InChIKey=FOJCQGSCRHNZMC-UHFFFAOYSA-N
【SMILES】
Cc1c(n(c(=O)[nH]1)C#N)C
【MOL File】
1H-IMIDAZOLE-1-CARBO….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:4
XLogP3:0.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
1H-IMIDAZOLE-1-CARBONITRILE,2,3-DIHYDRO-4,5-DIMETHYL-2-OXO-.cml