bis(chloranyl)methane hydrate

Systemtic Name: bis(chloranyl)methane hydrate Openeye Name: dichloromethane hydrate CAS Name: dichloromethane hydrate IUPAC Name: dichloromethane hydrate Traditional Name: dichloromethane hydrate Formula: C18H38Cl36O MolecularWeight: 1546.80172

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Descriptors Computed from Structure

Canonical SMILES:

C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.O

Isomeric SMILES

C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.O

InChI

InChI=1S/18CH2Cl2.H2O/c18*2-1-3;/h18*1H2;1H2