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2,5-dioxopyrrolidin-1-yl 14-({[(4E)-cyclooct-4-en-1-yloxy]carbonyl}amino)-3,6,9,12-tetraoxatetradecanoate

2,5-dioxopyrrolidin-1-yl 14-({[(4E)-cyclooct-4-en-1-yloxy]carbonyl}amino)-3,6,9,12-tetraoxatetradecanoate

CAS: 2714291-24-2

Formula: C23H36N2O10

SMILES: O=C(COCCOCCOCCOCCNC(=O)OC1CCCC=CCC1)ON1C(=O)CCC1=O

IUPAC: 2,5-dioxopyrrolidin-1-yl 14-({[(4E)-cyclooct-4-en-1-yloxy]carbonyl}amino)-3,6,9,12-tetraoxatetradecanoate

InChI: InChI=1/C23H36N2O10/c26-20-8-9-21(27)25(20)35-22(28)18-33-17-16-32-15-14-31-13-12-30-11-10-24-23(29)34-19-6-4-2-1-3-5-7-19/h1-2,19H,3-18H2,(H,24,29)/b2-1+

Composition: C (55.19%), H (7.25%), N (5.60%), O (31.96%)

Molar Mass: 500.545

Atom Count: 71

Heavy Atom Count: 35

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 500.236995367
Formal Charge 0
FSP3 0.74
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 8
Hydrogen Bond Donor Count 1
InChIKey LLTRGDCVNWNLKO-OWOJBTEDNA-N
Lipinski's Rule of Five
Molar Refractivity 123.13
Topological Polar Surface Area 138.93
Polarizability 48.35
Ring Count 2
Rotatable Bond Count 18

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 2714291-24-2 $217.35-$519.75$217.35$359.10$519.75
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