| Properties | Image |
|---|
| MNX_ID | MNXM1138507 |
 |
| reference | envipathM:...891e6649f9eb |
| formula | C12H12Cl4O5 |
| global charge | 0 |
| mol weight | 378.035 |
| InChIKey | KHKLVHHPVHBQSA-UHFFFAOYSA-N |
| InChI | InChI=1S/C12H12Cl4O5/c13-9-10(14)3-11(15,20)12(9,16)21-8(19)6(10)4-1-2-5(17)7(4)18/h4,6-7,9,18,20H,1-3H2 |
| SMILES | O=C1CCC(C2C(=O)OC3(Cl)C(Cl)C2(Cl)CC3(O)Cl)C1O |
MNX internals
| InChI (mnx) | InChI=1/C12H12Cl4O5/c13-9-10(14)3-11(15,20)12(9,16)21-8(19)6(10)4-1-2-5(17)7(4)18/h4,6-7,9,18,20H,1-3H2/t4?,6?,7?,9?,10?,11?,12? |
 |
| SMILES (mnx) | [CH2:1]1[CH2:2][C:5](=[O:17])[CH:7]([OH:18])[CH:4]1[CH:6]1[C:8](=[O:19])[O:21][C:12]2([Cl:16])[CH:9]([Cl:13])[C:10]1([Cl:14])[CH2:3][C:11]2([Cl:15])[OH:20] |
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