(3S)-1-[(benzyloxy)carbonyl]pyrrolidine-3-carboxylic acid

(3S)-1-[(benzyloxy)carbonyl]pyrrolidine-3-carboxylic acid

CAS: 192214-00-9

Formula: C13H15NO4

SMILES: OC(=O)[C@H]1CCN(C1)C(=O)OCC1=CC=CC=C1

IUPAC: (3S)-1-[(benzyloxy)carbonyl]pyrrolidine-3-carboxylic acid

InChI: InChI=1S/C13H15NO4/c15-12(16)11-6-7-14(8-11)13(17)18-9-10-4-2-1-3-5-10/h1-5,11H,6-9H2,(H,15,16)/t11-/m0/s1

Composition: C (62.64%), H (6.07%), N (5.62%), O (25.67%)

Molar Mass: 249.266

Atom Count: 33

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	249.100107967
Formal Charge	0
FSP3	0.38
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	JSASVUTVTRNJHA-NSHDSACASA-N
Lipinski's Rule of Five	1
Molar Refractivity	64.12
Topological Polar Surface Area	66.84
Polarizability	24.95
Ring Count	2
Rotatable Bond Count	4

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