CAS
952732-54-6 Purity
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952732-54-6 Purity
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1H-Imidazole-4-acetamide,2,5-dihydro-N-methyl-5-oxo-
CAS
952735-32-9
Catalog Number
ACM952735329
Category
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- Synthetic Use
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What is the molecular formula of the compound?
The molecular formula is C6H9N3O2.
What is the molecular weight of the compound?
The molecular weight is 155.15 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is N-methyl-2-(5-oxo-1,2-dihydroimidazol-4-yl)acetamide.
What is the InChI of the compound?
The InChI is InChI=1S/C6H9N3O2/c1-7-5(10)2-4-6(11)9-3-8-4/h2-3H2,1H3,(H,7,10)(H,9,11).
What is the InChIKey of the compound?
The InChIKey is IOTIUWIEUCSJLU-UHFFFAOYSA-N.
What is the canonical SMILES of the compound?
The canonical SMILES is CNC(=O)CC1=NCNC1=O.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is -1.4.
How many hydrogen bond donor atoms are there in the compound?
There are 2 hydrogen bond donor atoms.
How many hydrogen bond acceptor atoms are there in the compound?
There are 3 hydrogen bond acceptor atoms.
What is the topological polar surface area of the compound?
The topological polar surface area is 70.6 Å2.
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