tert-butyl (3S,4R)-3-amino-4-phenylpyrrolidine-1-carboxylate

tert-butyl (3S,4R)-3-amino-4-phenylpyrrolidine-1-carboxylate

CAS: 1643979-48-9

Formula: C15H22N2O2

SMILES: CC(C)(C)OC(=O)N1C[C@@H](N)[C@@H](C1)C1=CC=CC=C1

IUPAC: tert-butyl (3S,4R)-3-amino-4-phenylpyrrolidine-1-carboxylate

InChI: InChI=1S/C15H22N2O2/c1-15(2,3)19-14(18)17-9-12(13(16)10-17)11-7-5-4-6-8-11/h4-8,12-13H,9-10,16H2,1-3H3/t12-,13+/m0/s1

Composition: C (68.67%), H (8.45%), N (10.68%), O (12.20%)

Molar Mass: 262.353

Atom Count: 41

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	2
Exact Mass	262.168127956
Formal Charge	0
FSP3	0.53
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	UEGLRNLEEDBVTH-QWHCGFSZSA-N
Lipinski's Rule of Five	1
Molar Refractivity	74.72
Topological Polar Surface Area	55.56
Polarizability	29.6
Ring Count	2
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	1643979-48-9		$119.80-$546.01$119.80$200.50$546.01