937275-23-5
MOK-3 KETO
Name
MOK-3 KETO
Formula
C34 H32 Cl N O3 S
MolWeight
570.15
1Identification
【Name】
MOK-3 KETO
【CAS】
【MDL】
MFCD19705146
【English Synonyms】
【Formula】
C34 H32 Cl N O3 S
【MolWeight】
570.15
【Inchi】
InChI=1S/C34H32ClNO3S/c1-23(37)30-8-3-2-6-25(30)12-16-32(40-22-34(17-18-34)21-33(38)39)27-7-4-5-24(19-27)9-14-29-15-11-26-10-13-28(35)20-31(26)36-29/h2-11,13-15,19-20,32H,12,16-18,21-22H2,1H3,(H,38,39)/b14-9+/t32-/m1/s1
【InChIKey】
InChIKey=DYLOVNSFPNMSRY-OTVRWNPNSA-N
【SMILES】
CC(=O)c1ccccc1CC[C@H](c2cccc(c2)/C=C/c3ccc4ccc(cc4n3)Cl)SCC5(CC5)CC(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:9.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
MOK-3 KETO.cml
Quick Release
(2-DIMETHYLAMINO-PHENYL)-ACETIC ACID
132864-54-1
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150026-75-8 ;142569-70-8
MOK-3 KETO
937275-23-5
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