74051-80-2
SETHOXYDIM
Name
SETHOXYDIM
Formula
C17 H29 N O3 S
MolWeight
327.486
1Identification
【Name】
SETHOXYDIM
【CAS】
【MDL】
MFCD03792698
【English Synonyms】
【Formula】
C17 H29 N O3 S
【MolWeight】
327.486
【Inchi】
InChI=1S/C17H29NO3S/c1-5-8-14(18-21-6-2)17-15(19)10-13(11-16(17)20)9-12(4)22-7-3/h12-13,19H,5-11H2,1-4H3/b18-14+
【InChIKey】
InChIKey=CSPPKDPQLUUTND-NBVRZTHBSA-N
【SMILES】
CCC/C(=N\OCC)/C1=C(CC(CC1=O)CC(C)SCC)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
【WGK Germany】
2
4CML File
SETHOXYDIM.cml
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