4819-75-4 Purity
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Specification
The molecular formula of 2-Chloro-1,1,1-triethoxyethane is C8H17ClO3.
The synonyms of 2-Chloro-1,1,1-triethoxyethane are Triethyl Orthochloroacetate and Ethane, 2-chloro-1,1,1-triethoxy.
The molecular weight of 2-Chloro-1,1,1-triethoxyethane is 196.67 g/mol.
The IUPAC name of 2-Chloro-1,1,1-triethoxyethane is 2-chloro-1,1,1-triethoxyethane.
The InChI of 2-Chloro-1,1,1-triethoxyethane is InChI=1S/C8H17ClO3/c1-4-10-8(7-9,11-5-2)12-6-3/h4-7H2,1-3H3.
The InChIKey of 2-Chloro-1,1,1-triethoxyethane is URFKLQSFBXBOQU-UHFFFAOYSA-N.
The canonical SMILES of 2-Chloro-1,1,1-triethoxyethane is CCOC(CCl)(OCC)OCC.
The CAS number of 2-Chloro-1,1,1-triethoxyethane is 51076-95-0.
The XLogP3-AA value of 2-Chloro-1,1,1-triethoxyethane is 1.6.
Yes, 2-Chloro-1,1,1-triethoxyethane is a canonicalized compound.