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tert-butyl N-[(2R)-1-oxo-3-phenylpropan-2-yl]carbamate

tert-butyl N-[(2R)-1-oxo-3-phenylpropan-2-yl]carbamate

CAS: 77119-85-8

Formula: C14H19NO3

SMILES: CC(C)(C)OC(=O)N[C@H](CC1=CC=CC=C1)C=O

IUPAC: tert-butyl N-[(2R)-1-oxo-3-phenylpropan-2-yl]carbamate

InChI: InChI=1S/C14H19NO3/c1-14(2,3)18-13(17)15-12(10-16)9-11-7-5-4-6-8-11/h4-8,10,12H,9H2,1-3H3,(H,15,17)/t12-/m1/s1

Composition: C (67.45%), H (7.68%), N (5.62%), O (19.25%)

Molar Mass: 249.31

Atom Count: 37

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 249.136493476
Formal Charge 0
FSP3 0.43
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey ZJTYRNPLVNMVPQ-GFCCVEGCSA-N
Lipinski's Rule of Five 1
Molar Refractivity 69.06
Topological Polar Surface Area 55.4
Polarizability 27.03
Ring Count 1
Rotatable Bond Count 6

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95% <7 Days 77119-85-8 $17.60-$684.14$17.60$33.12$67.28$275.31$327.06$684.14
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95% <6 Days 77119-85-8 $211.60$211.60
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