152261-33-1 Purity
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Specification
The molecular formula is C16H14S3.
The IUPAC name is 1-ethenylsulfanyl-4-(4-ethenylsulfanylphenyl)sulfanylbenzene.
The InChI is InChI=1S/C16H14S3/c1-3-17-13-5-9-15(10-6-13)19-16-11-7-14(8-12-16)18-4-2/h3-12H,1-2H2.
The InChIKey is WQUQHXQTTKKFGY-UHFFFAOYSA-N.
The canonical SMILES is C=CSC1=CC=C(C=C1)SC2=CC=C(C=C2)SC=C.
The molecular weight is 302.5 g/mol.
The XLogP3-AA value is 6.
It does not have any hydrogen bond donor count.
It has 3 hydrogen bond acceptor counts.
It has 6 rotatable bond counts.