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The molecular formula of N-Boc-4-(methylamino)benzoic acid is C13H17NO4.
The molecular weight of N-Boc-4-(methylamino)benzoic acid is 251.28 g/mol.
N-Boc-4-(methylamino)benzoic acid is called 4-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]benzoic acid according to IUPAC nomenclature.
The InChI of N-Boc-4-(methylamino)benzoic acid is InChI=1S/C13H17NO4/c1-13(2,3)18-12(17)14(4)10-7-5-9(6-8-10)11(15)16/h5-8H,1-4H3,(H,15,16).
The InChIKey of N-Boc-4-(methylamino)benzoic acid is VRQKKKZQZSNRKD-UHFFFAOYSA-N.
The canonical SMILES representation of N-Boc-4-(methylamino)benzoic acid is CC(C)(C)OC(=O)N(C)C1=CC=C(C=C1)C(=O)O.
The CAS number of N-Boc-4-(methylamino)benzoic acid is 263021-30-3.
The XLogP3-AA value of N-Boc-4-(methylamino)benzoic acid is 2.2.
There is 1 hydrogen bond donor count in N-Boc-4-(methylamino)benzoic acid.
There are 4 rotatable bond counts in N-Boc-4-(methylamino)benzoic acid.
2-(Hexyloxy)benzaldehyde
3-Phenylpropyl butyrate
3-Ethoxycarbonylamino-3-(4-methoxy-phenyl)-propionic acid
4-[(2-Ethoxybenzoyl)amino]butanoic acid
(6,7-Dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-acetic acid
{3-[(tert-Butoxycarbonyl)amino]phenyl}acetic acid
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