5588-20-5
CLODANTOIN
Name
CLODANTOIN
Formula
C11 H17 Cl3 N2 O2 S
MolWeight
347.692
1Identification
【Name】
CLODANTOIN
【CAS】
【MDL】
MFCD00865604
【English Synonyms】
【Formula】
C11 H17 Cl3 N2 O2 S
【MolWeight】
347.692
【Inchi】
InChI=1S/C11H17Cl3N2O2S/c1-3-5-6-7(4-2)8-9(17)16(10(18)15-8)19-11(12,13)14/h7-8H,3-6H2,1-2H3,(H,15,18)
【InChIKey】
InChIKey=VOGJJBHRUDVEFM-UHFFFAOYSA-N
【SMILES】
CCCCC(CC)C1C(=O)N(C(=O)N1)SC(Cl)(Cl)Cl
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
CLODANTOIN.cml
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