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2-[(tert-butoxycarbonyl)amino]-3-(2-carbamoylphenyl)propanoic acid

2-[(tert-butoxycarbonyl)amino]-3-(2-carbamoylphenyl)propanoic acid

Formula: C15H20N2O5

SMILES: CC(C)(C)OC(=O)NC(CC1=CC=CC=C1C(N)=O)C(O)=O

IUPAC: 2-{[(tert-butoxy)carbonyl]amino}-3-(2-carbamoylphenyl)propanoic acid

InChI: InChI=1/C15H20N2O5/c1-15(2,3)22-14(21)17-11(13(19)20)8-9-6-4-5-7-10(9)12(16)18/h4-7,11H,8H2,1-3H3,(H2,16,18)(H,17,21)(H,19,20)

Composition: C (58.43%), H (6.54%), N (9.09%), O (25.94%)

Molar Mass: 308.334

Atom Count: 42

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 308.137221752
Formal Charge 0
FSP3 0.4
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 3
InChIKey FMPVOXUPJFIODB-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 79.07
Topological Polar Surface Area 118.72
Polarizability 30.39
Ring Count 1
Rotatable Bond Count 7

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Purity LeadTime Formula UnitPrice
98% <10 Days C15H20N2O5 Quote Only