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benzyl N-[(1S,4R)-4-[(tert-butoxycarbonyl)amino]cyclopent-2-en-1-yl]carbamate

benzyl N-[(1S,4R)-4-[(tert-butoxycarbonyl)amino]cyclopent-2-en-1-yl]carbamate

CAS: 1931997-83-9

Formula: C18H24N2O4

SMILES: CC(C)(C)OC(=O)N[C@@H]1C[C@H](NC(=O)OCC2=CC=CC=C2)C=C1

IUPAC: benzyl N-[(1S,4R)-4-{[(tert-butoxy)carbonyl]amino}cyclopent-2-en-1-yl]carbamate

InChI: InChI=1S/C18H24N2O4/c1-18(2,3)24-17(22)20-15-10-9-14(11-15)19-16(21)23-12-13-7-5-4-6-8-13/h4-10,14-15H,11-12H2,1-3H3,(H,19,21)(H,20,22)/t14-,15+/m1/s1

Composition: C (65.04%), H (7.28%), N (8.43%), O (19.25%)

Molar Mass: 332.4

Atom Count: 48

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 2
Exact Mass 332.173607261
Formal Charge 0
FSP3 0.44
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey MDMUXXADWNREFP-CABCVRRESA-N
Lipinski's Rule of Five 1
Molar Refractivity 90.98
Topological Polar Surface Area 76.66
Polarizability 35.27
Ring Count 2
Rotatable Bond Count 7

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Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 1931997-83-9 $218.15-$332.90$218.15$332.90
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