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The molecular formula is C13H16FNO2.
The molecular weight is 237.27 g/mol.
The IUPAC name is benzyl N-[(1R,3S)-3-fluorocyclopentyl]carbamate.
The InChI is InChI=1S/C13H16FNO2/c14-11-6-7-12(8-11)15-13(16)17-9-10-4-2-1-3-5-10/h1-5,11-12H,6-9H2,(H,15,16)/t11-,12+/m0/s1.
The InChIKey is NDVBOSIQTJVVNB-NWDGAFQWSA-N.
The canonical SMILES is C1CC(CC1NC(=O)OCC2=CC=CC=C2)F.
The isomeric SMILES is C1C[C@@H](C[C@@H]1NC(=O)OCC2=CC=CC=C2)F.
The XLogP3-AA value is 2.8.
It has 1 hydrogen bond donor count.
It has 4 rotatable bond counts.
932702-41-5
93270-28-0
932704-49-9
932710-51-5
93271-59-1
932-72-9
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