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compound 0086186

PropertiesImage
MNX_IDMNXM1183987 Image of MNXM1183987
referenceenvipathM:...5a4c791fd9e6
formulaC12H14Cl2O3
global charge0
mol weight277.147
InChIKeyCKPMQBJBLOZITM-UHFFFAOYSA-N
InChIInChI=1S/C12H14Cl2O3/c13-6-1-4-2-11(6,14)12(16)5-3-10(15,8(4)12)9-7(5)17-9/h4-9,15-16H,1-3H2
SMILESOC12CC(C3OC31)C1(O)C2C2CC(Cl)C1(Cl)C2
MNX internals
InChI (mnx)InChI=1/C12H14Cl2O3/c13-6-1-4-2-11(6,14)12(16)5-3-10(15,8(4)12)9-7(5)17-9/h4-9,15-16H,1-3H2/t4?,5?,6?,7?,8?,9?,10?,11?,12? Image of MNXM1183987
SMILES (mnx)[CH2:1]1[CH:4]2[CH2:2][C:11]([Cl:14])([CH:6]1[Cl:13])[C:12]1([OH:16])[CH:5]3[CH2:3][C:10]([OH:15])([CH:8]21)[CH:9]1[CH:7]3[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:...5a4c791fd9e6
envipathM:...5a4c791fd9e6
CKPMQBJBLOZITM-UHFFFAOYSA-N
compound 0086186