1-(tert-butoxycarbonyl)-4-phenylpiperidine-3-carboxylic acid

1-(tert-butoxycarbonyl)-4-phenylpiperidine-3-carboxylic acid

CAS: 221141-79-3

Formula: C17H23NO4

SMILES: CC(C)(C)OC(=O)N1CCC(C(C1)C(O)=O)C1=CC=CC=C1

IUPAC: 1-[(tert-butoxy)carbonyl]-4-phenylpiperidine-3-carboxylic acid

InChI: InChI=1/C17H23NO4/c1-17(2,3)22-16(21)18-10-9-13(14(11-18)15(19)20)12-7-5-4-6-8-12/h4-8,13-14H,9-11H2,1-3H3,(H,19,20)

Composition: C (66.86%), H (7.59%), N (4.59%), O (20.96%)

Molar Mass: 305.374

Atom Count: 45

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	2
Exact Mass	305.162708225
Formal Charge	0
FSP3	0.53
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	UHRXHCZPUWORFZ-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	82.56
Topological Polar Surface Area	66.84
Polarizability	32.28
Ring Count	2
Rotatable Bond Count	4

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