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

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

CAS: 189625-14-7

Formula: C12H19NO4

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

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

InChI: InChI=1S/C12H19NO4/c1-8(14)16-10-6-5-9(7-10)13-11(15)17-12(2,3)4/h5-6,9-10H,7H2,1-4H3,(H,13,15)/t9-,10+/m0/s1

Composition: C (59.73%), H (7.94%), N (5.81%), O (26.52%)

Molar Mass: 241.287

Atom Count: 36

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 241.131408096
Formal Charge 0
FSP3 0.67
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey KSRJRUTXLAQMEK-VHSXEESVSA-N
Lipinski's Rule of Five 1
Molar Refractivity 62.79
Topological Polar Surface Area 64.63
Polarizability 24.58
Ring Count 1
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
98% <2 Days 189625-14-7 $179.40-$4,597.70$179.40$243.80$373.75$631.35$1,147.70$4,597.70
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