CAS
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Specification
The molecular formula is C14H19NO3.
The molecular weight is 249.30 g/mol.
The IUPAC name is tert-butyl N-(1-oxo-3-phenylpropan-2-yl)carbamate.
The InChI is InChI=1S/C14H19NO3/c1-14(2,3)18-13(17)15-12(10-16)9-11-7-5-4-6-8-11/h4-8,10,12H,9H2,1-3H3,(H,15,17).
The InChIKey is ZJTYRNPLVNMVPQ-UHFFFAOYSA-N.
The canonical SMILES is CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C=O.
The CAS number is 103127-53-3.
The XLogP3-AA value is 2.5.
It has 1 hydrogen bond donor count.
It has 3 hydrogen bond acceptor counts.