(3R,6R)-1-(tert-butoxycarbonyl)-6-methylpiperidine-3-carboxylic acid

(3R,6R)-1-(tert-butoxycarbonyl)-6-methylpiperidine-3-carboxylic acid

CAS: 1417705-89-5

Formula: C12H21NO4

SMILES: C[C@@H]1CC[C@H](CN1C(=O)OC(C)(C)C)C(O)=O

IUPAC: (3R,6R)-1-[(tert-butoxy)carbonyl]-6-methylpiperidine-3-carboxylic acid

InChI: InChI=1S/C12H21NO4/c1-8-5-6-9(10(14)15)7-13(8)11(16)17-12(2,3)4/h8-9H,5-7H2,1-4H3,(H,14,15)/t8-,9-/m1/s1

Composition: C (59.24%), H (8.70%), N (5.76%), O (26.30%)

Molar Mass: 243.303

Atom Count: 38

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	2
Exact Mass	243.14705816
Formal Charge	0
FSP3	0.83
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	TZCMQIKRCZLVQN-RKDXNWHRSA-N
Lipinski's Rule of Five	1
Molar Refractivity	62.34
Topological Polar Surface Area	66.84
Polarizability	24.58
Ring Count	1
Rotatable Bond Count	3

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