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methyl 3-{[(benzyloxy)carbonyl]amino}-2-[(tert-butoxycarbonyl)amino]propanoate

methyl 3-{[(benzyloxy)carbonyl]amino}-2-[(tert-butoxycarbonyl)amino]propanoate

CAS: 355377-04-7

Formula: C17H24N2O6

SMILES: COC(=O)C(CNC(=O)OCC1=CC=CC=C1)NC(=O)OC(C)(C)C

IUPAC: methyl 3-{[(benzyloxy)carbonyl]amino}-2-{[(tert-butoxy)carbonyl]amino}propanoate

InChI: InChI=1/C17H24N2O6/c1-17(2,3)25-16(22)19-13(14(20)23-4)10-18-15(21)24-11-12-8-6-5-7-9-12/h5-9,13H,10-11H2,1-4H3,(H,18,21)(H,19,22)

Composition: C (57.94%), H (6.87%), N (7.95%), O (27.24%)

Molar Mass: 352.387

Atom Count: 49

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 352.163436501
Formal Charge 0
FSP3 0.47
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey FLUZWIRUXDMVNJ-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 89.02
Topological Polar Surface Area 102.96
Polarizability 35.23
Ring Count 1
Rotatable Bond Count 10

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Purity LeadTime CAS UnitPrice
98% <10 Days 355377-04-7 Quote Only
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Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 355377-04-7 $221.95-$6,762.00$221.95$327.75$540.50$966.00$1,817.00$6,762.00
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