50530-43-3
5-(DODECYLDITHIO)-1,3,4-THIADIAZOLE-2(3H)-THIONE
Name
5-(DODECYLDITHIO)-1,3,4-THIADIAZOLE-2(3H)-THIONE
Formula
C14 H26 N2 S4
MolWeight
350.637
1Identification
【Name】
5-(DODECYLDITHIO)-1,3,4-THIADIAZOLE-2(3H)-THIONE
【CAS】
【MDL】
MFCD23160498
【English Synonyms】
【Formula】
C14 H26 N2 S4
【MolWeight】
350.637
【Inchi】
InChI=1S/C14H26N2S4/c1-2-3-4-5-6-7-8-9-10-11-12-18-20-14-16-15-13(17)19-14/h2-12H2,1H3,(H,15,17)
【InChIKey】
InChIKey=JGKULQMKNNNNKK-UHFFFAOYSA-N
【SMILES】
CCCCCCCCCCCCSSc1n[nH]c(=S)s1
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-(DODECYLDITHIO)-1,3,4-THIADIAZOLE-2(3H)-THIONE.cml
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