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benzyl N-[(3R,4R)-4-hydroxypyrrolidin-3-yl]carbamate

benzyl N-[(3R,4R)-4-hydroxypyrrolidin-3-yl]carbamate

CAS: 1810070-09-7

Formula: C12H16N2O3

SMILES: O[C@@H]1CNC[C@H]1NC(=O)OCC1=CC=CC=C1

IUPAC: benzyl N-[(3R,4R)-4-hydroxypyrrolidin-3-yl]carbamate

InChI: InChI=1S/C12H16N2O3/c15-11-7-13-6-10(11)14-12(16)17-8-9-4-2-1-3-5-9/h1-5,10-11,13,15H,6-8H2,(H,14,16)/t10-,11-/m1/s1

Composition: C (61.00%), H (6.83%), N (11.86%), O (20.31%)

Molar Mass: 236.271

Atom Count: 33

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 2
Exact Mass 236.116092383
Formal Charge 0
FSP3 0.42
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 3
InChIKey XFRZHUKQUUVRFG-GHMZBOCLSA-N
Lipinski's Rule of Five 1
Molar Refractivity 61.99
Topological Polar Surface Area 70.59
Polarizability 24.71
Ring Count 2
Rotatable Bond Count 4

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