tris(chloranyl)methane; 3,3,3-tris(chloranyl)propan-1-ol

Systemtic Name: tris(chloranyl)methane; 3,3,3-tris(chloranyl)propan-1-ol Openeye Name: chloroform; 3,3,3-trichloropropan-1-ol CAS Name: chloroform; 3,3,3-trichloro-1-propanol IUPAC Name: chloroform; 3,3,3-trichloropropan-1-ol Traditional Name: chloroform; 3,3,3-trichloropropan-1-ol Formula: C22H24Cl60O MolecularWeight: 2431.60536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(CO)C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl

Isomeric SMILES

C(CO)C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl

InChI

InChI=1S/C3H5Cl3O.19CHCl3/c4-3(5,6)1-2-7;19*2-1(3)4/h7H,1-2H2;19*1H