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compound 0095385

PropertiesImage
MNX_IDMNXM1172754 Image of MNXM1172754
referenceenvipathM:...62a214794d86
formulaC12H8Cl4O4
global charge0
mol weight358.004
InChIKeyCNZGIFZXCIECSQ-UHFFFAOYSA-N
InChIInChI=1S/C12H8Cl4O4/c13-5-3-10(15)8(19)6(12(5,16)9(10)14)11(20)2-1-4(17)7(11)18/h3,6,9,20H,1-2H2
SMILESO=C1CCC(O)(C2C(=O)C3(Cl)C=C(Cl)C2(Cl)C3Cl)C1=O
MNX internals
InChI (mnx)InChI=1/C12H8Cl4O4/c13-5-3-10(15)8(19)6(12(5,16)9(10)14)11(20)2-1-4(17)7(11)18/h3,6,9,20H,1-2H2/t6?,9?,10?,11?,12? Image of MNXM1172754
SMILES (mnx)[CH2:1]1[CH2:2][C:11]([CH:6]2[C:8](=[O:19])[C:10]3([Cl:15])[CH:3]=[C:5]([Cl:13])[C:12]2([Cl:16])[CH:9]3[Cl:14])([OH:20])[C:7](=[O:18])[C:4]1=[O:17]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

envipath:...62a214794d86
envipathM:...62a214794d86
CNZGIFZXCIECSQ-UHFFFAOYSA-N
compound 0095385