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(2R)-2-{[(benzyloxy)carbonyl]amino}-5-methoxy-5-oxopentanoic acid

(2R)-2-{[(benzyloxy)carbonyl]amino}-5-methoxy-5-oxopentanoic acid

CAS: 4652-65-7

Formula: C14H17NO6

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

IUPAC: (2R)-2-{[(benzyloxy)carbonyl]amino}-5-methoxy-5-oxopentanoic acid

InChI: InChI=1S/C14H17NO6/c1-20-12(16)8-7-11(13(17)18)15-14(19)21-9-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3,(H,15,19)(H,17,18)/t11-/m1/s1

Composition: C (56.95%), H (5.80%), N (4.74%), O (32.51%)

Molar Mass: 295.291

Atom Count: 38

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 295.105587271
Formal Charge 0
FSP3 0.36
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey JSNVOAWDAFVIKY-LLVKDONJSA-N
Lipinski's Rule of Five 1
Molar Refractivity 71.74
Topological Polar Surface Area 101.93
Polarizability 28.36
Ring Count 1
Rotatable Bond Count 9

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