CAS
908267-49-2 Purity
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908267-49-2 Purity
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The molecular formula is C6H9N3S.
The molecular weight is 155.22 g/mol.
The IUPAC name is 5-(1-methylcyclopropyl)-1,3,4-thiadiazol-2-amine.
The InChI is InChI=1S/C6H9N3S/c1-6(2-3-6)4-8-9-5(7)10-4/h2-3H2,1H3,(H2,7,9).
The InChIKey is YLCDVSLTWVMHOW-UHFFFAOYSA-N.
The canonical SMILES is CC1(CC1)C2=NN=C(S2)N.
The XLogP3-AA value is 1.1.
It has 1 hydrogen bond donor count.
It has 4 hydrogen bond acceptor counts.
It has 1 rotatable bond count.