CAS
93668-43-0 Purity
97%
93668-43-0 Purity
97%
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4-Chloro-6-(4-methyl-1H-imidazol-1-yl)pyrimidine
CAS
941294-32-2
Catalog Number
ACM941294322
Category
Imidazoles
Molecular Weight
194.62
Molecular Formula
C8H7ClN4
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Specification
Appearance
White powder
What is the molecular formula of the compound?
The molecular formula of the compound is C8H7ClN4.
What is the molecular weight of the compound?
The molecular weight of the compound is 194.62 g/mol.
What is the IUPAC name of the compound?
The IUPAC name of the compound is 4-chloro-6-(4-methylimidazol-1-yl)pyrimidine.
What is the InChI of the compound?
The InChI of the compound is InChI=1S/C8H7ClN4/c1-6-3-13(5-12-6)8-2-7(9)10-4-11-8/h2-5H,1H3.
What is the InChIKey of the compound?
The InChIKey of the compound is NTJLKUOVJHBYPT-UHFFFAOYSA-N.
What is the Canonical SMILES of the compound?
The Canonical SMILES of the compound is CC1=CN(C=N1)C2=CC(=NC=N2)Cl.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value of the compound is 1.6.
How many hydrogen bond acceptors does the compound have?
The compound has 3 hydrogen bond acceptors.
What is the topological polar surface area of the compound?
The topological polar surface area of the compound is 43.6 Å2.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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