Molecule ID: 441093

IUPAC Name: (3R,4S,5S,6R)-1,3,4,5,6-pentachlorocyclohexene

Description: The molecule is a chlorocyclohexene that is cyclohexene which carries 5 chlorines at positions 1,3,4,5 and 6, respectively. It has (3R,4S,5S,6R) configuration. It is an enantiomer of a (3S,4R,5R,6S)-1,3,4,5,6-pentachlorocyclohexene.

SMILES: ClC1=C[C@@H](Cl)[C@H](Cl)[C@H](Cl)[C@H]1Cl

SELFIES: [Cl][C][=C][C@@H1][Branch1][C][Cl][C@H1][Branch1][C][Cl][C@H1][Branch1][C][Cl][C@H1][Ring1][=Branch2][Cl]

InChI: InChI=1S/C6H5Cl5/c7-2-1-3(8)5(10)6(11)4(2)9/h1-2,4-6H/t2-,4+,5+,6+/m1/s1

Molecular Properties:
- Polar Surface Area: 0.0 Ų
- LogP: 3.8