CAS
90203-81-9 Purity
>98
90203-81-9 Purity
>98
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Specification
The molecular formula is C8H15NO3.
The synonyms are N-butanoylglycine ethyl ester and Ethyl 2-(butanoylamino)acetate.
The molecular weight is 173.21 g/mol.
The IUPAC name is ethyl 2-(butanoylamino)acetate.
The InChI is InChI=1S/C8H15NO3/c1-3-5-7(10)9-6-8(11)12-4-2/h3-6H2,1-2H3,(H,9,10).
The InChIKey is DEXXMKJDIKLHEN-UHFFFAOYSA-N.
The canonical SMILES is CCCC(=O)NCC(=O)OCC.
The CAS number is 90205-46-2.
The XLogP3-AA value is 0.7.
Yes, it is a canonicalized compound.