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methyl (2R)-2-{[(benzyloxy)carbonyl]amino}-3-hydroxypropanoate

methyl (2R)-2-{[(benzyloxy)carbonyl]amino}-3-hydroxypropanoate

CAS: 93204-36-5

Formula: C12H15NO5

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

IUPAC: methyl (2R)-2-{[(benzyloxy)carbonyl]amino}-3-hydroxypropanoate

InChI: InChI=1S/C12H15NO5/c1-17-11(15)10(7-14)13-12(16)18-8-9-5-3-2-4-6-9/h2-6,10,14H,7-8H2,1H3,(H,13,16)/t10-/m1/s1

Composition: C (56.91%), H (5.97%), N (5.53%), O (31.59%)

Molar Mass: 253.254

Atom Count: 33

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 253.095022587
Formal Charge 0
FSP3 0.33
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey CINAUOAOVQPWIB-SNVBAGLBSA-N
Lipinski's Rule of Five 1
Molar Refractivity 62.49
Topological Polar Surface Area 84.86
Polarizability 24.74
Ring Count 1
Rotatable Bond Count 7

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