chlorobutanol hydrate
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IUPAC Name :1,1,1-trichloro-2-methylpropan-2-ol;hydrate
InChI :InChI=1/2C4H7Cl3O.H2O/c2*1-3(2,8)4(5,6)7;/h2*8H,1-2H3;1H2
Std.InChI: InChI=1S/2C4H7Cl3O.H2O/c2*1-3(2,8)4(5,6)7;/h2*8H,1-2H3;1H2
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InChIKey :WRWLCXJYIMRJIN-UHFFFAOYAY
Std.InChIKey: WRWLCXJYIMRJIN-UHFFFAOYSA-N
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SMILES :ClC(Cl)(Cl)C(O)(C)C.ClC(Cl)(Cl)C(O)(C)C.O