56784-39-5
OZOLINONE
Name
OZOLINONE
Formula
C11 H16 N2 O3 S
MolWeight
256.324
1Identification
【Name】
OZOLINONE
【CAS】
【MDL】
MFCD00867315
【English Synonyms】
【Formula】
C11 H16 N2 O3 S
【MolWeight】
256.324
【Inchi】
InChI=1S/C11H16N2O3S/c1-12-8(7-9(14)15)17-11(10(12)16)13-5-3-2-4-6-13/h7,11H,2-6H2,1H3,(H,14,15)/b8-7+
【InChIKey】
InChIKey=NQFBZYYUAFJYNS-BQYQJAHWSA-N
【SMILES】
CN1/C(=C\C(=O)O)/SC(C1=O)N2CCCCC2
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
OZOLINONE.cml
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