CAS
90950-09-7 Purity
96%
90950-09-7 Purity
96%
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PubChem CID 45118554.
The molecular formula is C9H17NS2.
The molecular weight is 203.4 g/mol.
The IUPAC name is 1-(3-ethylsulfanylpropyl)pyrrolidine-2-thione.
The InChI is InChI=1S/C9H17NS2/c1-2-12-8-4-7-10-6-3-5-9(10)11/h2-8H2,1H3.
The InChIKey is KGVOWPWRLIUDOC-UHFFFAOYSA-N.
The canonical SMILES is CCSCCCN1CCCC1=S.
The XLogP3-AA value is 1.8.
It has 0 hydrogen bond donor counts.
It has 2 hydrogen bond acceptor counts.