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Specification
The molecular formula is C15H19NO6.
The synonyms are 149520-06-9, 3-(Benzo[d][1,3]dioxol-5-yl)-3-((tert-butoxycarbonyl)amino)propanoic acid, 3-(1,3-benzodioxol-5-yl)-3-[(tert-butoxycarbonyl)amino]propanoic acid, 3-(1,3-benzodioxol-5-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid, 3-Benzo[1,3]dioxol-5-yl-3-tert-butoxycarbonylamino-propionic acid.
The molecular weight is 309.31 g/mol.
The IUPAC name is 3-(1,3-benzodioxol-5-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid.
The InChI Key is UOQWIQGAZKFCDC-UHFFFAOYSA-N.
The Canonical SMILES is CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC2=C(C=C1)OCO2.
The CAS number is 149520-06-9.
The XLogP3-AA value is 1.8.
The compound has 2 hydrogen bond donor counts.
The compound has 6 hydrogen bond acceptor counts.