1-(tert-butoxycarbonyl)-4-methoxypiperidine-2-carboxylic acid

1-(tert-butoxycarbonyl)-4-methoxypiperidine-2-carboxylic acid

CAS: 1263377-95-2

Formula: C12H21NO5

SMILES: COC1CCN(C(C1)C(O)=O)C(=O)OC(C)(C)C

IUPAC: 1-[(tert-butoxy)carbonyl]-4-methoxypiperidine-2-carboxylic acid

InChI: InChI=1/C12H21NO5/c1-12(2,3)18-11(16)13-6-5-8(17-4)7-9(13)10(14)15/h8-9H,5-7H2,1-4H3,(H,14,15)

Composition: C (55.58%), H (8.16%), N (5.40%), O (30.85%)

Molar Mass: 259.302

Atom Count: 39

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	2
Exact Mass	259.14197278
Formal Charge	0
FSP3	0.83
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	HZCNIGRPBBQZMH-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	63.99
Topological Polar Surface Area	76.07
Polarizability	25.32
Ring Count	1
Rotatable Bond Count	4

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96%	<2 Days	1263377-95-2		$165.60-$3,447.70$165.60$216.20$316.25$516.35$885.50$3,447.70