4-(3-bromophenyl)-1-(tert-butoxycarbonyl)pyrrolidine-3-carboxylic acid

4-(3-bromophenyl)-1-(tert-butoxycarbonyl)pyrrolidine-3-carboxylic acid

Formula: C16H20BrNO4

SMILES: CC(C)(C)OC(=O)N1CC(C(C1)C1=CC(Br)=CC=C1)C(O)=O

IUPAC: 4-(3-bromophenyl)-1-[(tert-butoxy)carbonyl]pyrrolidine-3-carboxylic acid

InChI: InChI=1/C16H20BrNO4/c1-16(2,3)22-15(21)18-8-12(13(9-18)14(19)20)10-5-4-6-11(17)7-10/h4-7,12-13H,8-9H2,1-3H3,(H,19,20)

Composition: C (51.91%), H (5.45%), Br (21.58%), N (3.78%), O (17.28%)

Molar Mass: 370.243

Atom Count: 42

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	2
Exact Mass	369.057571
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	WLZJBSBJNUMFEY-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	85.5
Topological Polar Surface Area	66.84
Polarizability	33.31
Ring Count	2
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C16H20BrNO4		Quote Only