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compound 0082004

PropertiesImage
MNX_IDMNXM1178559 Image of MNXM1178559
referenceenvipathM:...b94d1725a1eb
formulaC12H13Cl3O2
global charge0
mol weight295.593
InChIKeyIZOSOSAEUMQCLS-UHFFFAOYSA-N
InChIInChI=1S/C12H13Cl3O2/c13-7-4-2-11(15,10(7)14)12(16)5-1-3(6(4)12)8-9(5)17-8/h3-10,16H,1-2H2
SMILESOC12C3CC(C4OC43)C1C1CC2(Cl)C(Cl)C1Cl
MNX internals
InChI (mnx)InChI=1/C12H13Cl3O2/c13-7-4-2-11(15,10(7)14)12(16)5-1-3(6(4)12)8-9(5)17-8/h3-10,16H,1-2H2/t3?,4?,5?,6?,7?,8?,9?,10?,11?,12? Image of MNXM1178559
SMILES (mnx)[CH2:1]1[CH:3]2[CH:6]3[CH:4]4[CH2:2][C:11]([Cl:15])([CH:10]([Cl:14])[CH:7]4[Cl:13])[C:12]3([OH:16])[CH:5]1[CH:9]1[CH:8]2[O:17]1
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:...b94d1725a1eb
envipathM:...b94d1725a1eb
IZOSOSAEUMQCLS-UHFFFAOYSA-N
compound 0082004