2609-88-3 Purity
98%
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The molecular formula of the compound is C11H23N3S.
The molecular weight of the compound is 229.39 g/mol.
The IUPAC name of the compound is 11-azidoundecane-1-thiol.
The InChI of the compound is InChI=1S/C11H23N3S/c12-14-13-10-8-6-4-2-1-3-5-7-9-11-15/h15H,1-11H2.
The InChIKey of the compound is YXXLZBNUURBJQC-UHFFFAOYSA-N.
The canonical SMILES of the compound is C(CCCCCN=[N+]=[N-])CCCCCS.
The CAS number of the compound is 668420-70-0.
The XLogP3-AA value of the compound is 5.6.
The compound has 1 hydrogen bond donor count.
The compound has 11 rotatable bond counts.