(2S)-1-[(9H-fluoren-9-ylmethoxy)carbonyl]piperidine-2-carboxylic acid

(2S)-1-[(9H-fluoren-9-ylmethoxy)carbonyl]piperidine-2-carboxylic acid

CAS: 86069-86-5

Formula: C21H21NO4

SMILES: OC(=O)[C@@H]1CCCCN1C(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12

IUPAC: (2S)-1-{[(9H-fluoren-9-yl)methoxy]carbonyl}piperidine-2-carboxylic acid

InChI: InChI=1S/C21H21NO4/c23-20(24)19-11-5-6-12-22(19)21(25)26-13-18-16-9-3-1-7-14(16)15-8-2-4-10-17(15)18/h1-4,7-10,18-19H,5-6,11-13H2,(H,23,24)/t19-/m0/s1

Composition: C (71.78%), H (6.02%), N (3.99%), O (18.21%)

Molar Mass: 351.402

Atom Count: 47

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	351.14705816
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	CKLAZLINARHOTG-IBGZPJMESA-N
Lipinski's Rule of Five	1
Molar Refractivity	96.87
Topological Polar Surface Area	66.84
Polarizability	38.79
Ring Count	4
Rotatable Bond Count	4

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