| Properties | Image |
|---|
| MNX_ID | MNXM1183664 |
 |
| reference | envipathM:...812c19caf995 |
| formula | C12H12Cl4O4 |
| global charge | 0 |
| mol weight | 362.036 |
| InChIKey | GQTLICPCTMZWJM-UHFFFAOYSA-N |
| InChI | InChI=1S/C12H12Cl4O4/c13-6-4-5(11(20)2-1-3(17)9(11)18)10(19)12(16,7(4)14)8(6)15/h4-9,18,20H,1-2H2 |
| SMILES | O=C1CCC(O)(C2C(=O)C3(Cl)C(Cl)C(Cl)C2C3Cl)C1O |
MNX internals
| InChI (mnx) | InChI=1/C12H12Cl4O4/c13-6-4-5(11(20)2-1-3(17)9(11)18)10(19)12(16,7(4)14)8(6)15/h4-9,18,20H,1-2H2/t4?,5?,6?,7?,8?,9?,11?,12? |
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| SMILES (mnx) | [CH2:1]1[CH2:2][C:11]([CH:5]2[CH:4]3[CH:6]([Cl:13])[CH:8]([Cl:15])[C:12]([Cl:16])([CH:7]3[Cl:14])[C:10]2=[O:19])([OH:20])[CH:9]([OH:18])[C:3]1=[O:17] |
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