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Specification
The PubChem CID of 2,4-Dichloro-1-(2-propynyloxy)benzene is 176889.
The molecular formula of 2,4-Dichloro-1-(2-propynyloxy)benzene is C9H6Cl2O.
The molecular weight of 2,4-Dichloro-1-(2-propynyloxy)benzene is 201.05 g/mol.
The IUPAC name of 2,4-Dichloro-1-(2-propynyloxy)benzene is 2,4-dichloro-1-prop-2-ynoxybenzene.
The InChI of 2,4-Dichloro-1-(2-propynyloxy)benzene is InChI=1S/C9H6Cl2O/c1-2-5-12-9-4-3-7(10)6-8(9)11/h1,3-4,6H,5H2.
The InChIKey of 2,4-Dichloro-1-(2-propynyloxy)benzene is KEIKGHHJUQTGSZ-UHFFFAOYSA-N.
The canonical SMILES of 2,4-Dichloro-1-(2-propynyloxy)benzene is C#CCOC1=C(C=C(C=C1)Cl)Cl.
The CAS number of 2,4-Dichloro-1-(2-propynyloxy)benzene is 17061-90-4.
The XLogP3 value of 2,4-Dichloro-1-(2-propynyloxy)benzene is 3.3.
Yes, 2,4-Dichloro-1-(2-propynyloxy)benzene is a canonicalized compound.