7-tert-butyl 2-methyl (1S,2S,4R)-7-azabicyclo[2.2.1]heptane-2,7-dicarboxylate

7-tert-butyl 2-methyl (1S,2S,4R)-7-azabicyclo[2.2.1]heptane-2,7-dicarboxylate

CAS: 197080-73-2

Formula: C13H21NO4

SMILES: [H][C@@]12CC[C@@]([H])([C@H](C1)C(=O)OC)N2C(=O)OC(C)(C)C

IUPAC: 7-tert-butyl 2-methyl (1S,2S,4R)-7-azabicyclo[2.2.1]heptane-2,7-dicarboxylate

InChI: InChI=1S/C13H21NO4/c1-13(2,3)18-12(16)14-8-5-6-10(14)9(7-8)11(15)17-4/h8-10H,5-7H2,1-4H3/t8-,9+,10+/m1/s1

Composition: C (61.16%), H (8.29%), N (5.49%), O (25.07%)

Molar Mass: 255.314

Atom Count: 39

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	3
Exact Mass	255.14705816
Formal Charge	0
FSP3	0.85
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	ZBESKVIRYNQXCD-UTLUCORTSA-N
Lipinski's Rule of Five	1
Molar Refractivity	64.97
Topological Polar Surface Area	55.84
Polarizability	25.94
Ring Count	2
Rotatable Bond Count	4

Suppliers

Shanghai AQ BioPharma Co., Ltd.

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<8 Days	197080-73-2		$340.00-$4,896.00$340.00$1,020.00$1,632.00$3,060.00$4,896.00