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Details

Stereochemistry ACHIRAL
Molecular Formula C18H12Cl12
Molecular Weight 653.724
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DODECACHLOROPENTACYCLOOCTADECADIENE, SYN-

SMILES

[H][C@]12CC[C@]3([H])[C@]([H])(CC[C@@]1([H])[C@@]4(Cl)C(Cl)=C(Cl)[C@]2(Cl)C4(Cl)Cl)[C@]5(Cl)C(Cl)=C(Cl)[C@@]3(Cl)C5(Cl)Cl

InChI

InChIKey=UGQQAJOWXNCOPY-MXYLTYEXSA-N
InChI=1S/C18H12Cl12/c19-9-10(20)15(25)7-3-4-8-6(2-1-5(7)13(9,23)17(15,27)28)14(24)11(21)12(22)16(8,26)18(14,29)30/h5-8H,1-4H2/t5-,6+,7+,8-,13-,14+,15+,16-

HIDE SMILES / InChI

Molecular Formula C18H12Cl12
Molecular Weight 653.724
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
8VQI6058B5
Record Status Validated (UNII)
Record Version