tert-butyl 3-{[(tert-butoxycarbonyl)amino]methyl}-4-hydroxypyrrolidine-1-carboxylate

tert-butyl 3-{[(tert-butoxycarbonyl)amino]methyl}-4-hydroxypyrrolidine-1-carboxylate

CAS: 175463-34-0

Formula: C15H28N2O5

SMILES: CC(C)(C)OC(=O)NCC1CN(CC1O)C(=O)OC(C)(C)C

IUPAC: tert-butyl 3-({[(tert-butoxy)carbonyl]amino}methyl)-4-hydroxypyrrolidine-1-carboxylate

InChI: InChI=1/C15H28N2O5/c1-14(2,3)21-12(19)16-7-10-8-17(9-11(10)18)13(20)22-15(4,5)6/h10-11,18H,7-9H2,1-6H3,(H,16,19)

Composition: C (56.94%), H (8.92%), N (8.85%), O (25.28%)

Molar Mass: 316.398

Atom Count: 50

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	2
Exact Mass	316.19982201
Formal Charge	0
FSP3	0.87
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	VSFCEPRNHYOLGU-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	81.06
Topological Polar Surface Area	88.1
Polarizability	32.13
Ring Count	1
Rotatable Bond Count	6

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Purity	LeadTime	CAS	PacketSize	UnitPrice
96%	<7 Days	175463-34-0		$319.82-$1,057.77$319.82$1,057.77