(2R)-7-(tert-butoxycarbonyl)-7-azabicyclo[2.2.1]heptane-2-carboxylic acid

(2R)-7-(tert-butoxycarbonyl)-7-azabicyclo[2.2.1]heptane-2-carboxylic acid

CAS: 918411-43-5

Formula: C12H19NO4

SMILES: CC(C)(C)OC(=O)N1C2CCC1[C@@H](C2)C(O)=O

IUPAC: (2R)-7-[(tert-butoxy)carbonyl]-7-azabicyclo[2.2.1]heptane-2-carboxylic acid

InChI: InChI=1S/C12H19NO4/c1-12(2,3)17-11(16)13-7-4-5-9(13)8(6-7)10(14)15/h7-9H,4-6H2,1-3H3,(H,14,15)/t7?,8-,9?/m1/s1

Composition: C (59.73%), H (7.94%), N (5.81%), O (26.52%)

Molar Mass: 241.287

Atom Count: 36

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	3
Exact Mass	241.131408096
Formal Charge	0
FSP3	0.83
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	XRDRXGVDCVQVPV-QJAFJHJLSA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.2
Topological Polar Surface Area	66.84
Polarizability	23.87
Ring Count	2
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	918411-43-5		$2,200.00-$5,040.00$2,200.00$3,300.00$5,040.00