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2,5-dioxopyrrolidin-1-yl 2,5,8,11,14,17,20,23,26,29,32,35,38,41,44,47-hexadecaoxapentacontan-50-oate

2,5-dioxopyrrolidin-1-yl 2,5,8,11,14,17,20,23,26,29,32,35,38,41,44,47-hexadecaoxapentacontan-50-oate

CAS: 174569-25-6

Formula: C38H71NO20

SMILES: COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)ON1C(=O)CCC1=O

IUPAC: 2,5-dioxopyrrolidin-1-yl 2,5,8,11,14,17,20,23,26,29,32,35,38,41,44,47-hexadecaoxapentacontan-50-oate

InChI: InChI=1S/C38H71NO20/c1-43-6-7-45-10-11-47-14-15-49-18-19-51-22-23-53-26-27-55-30-31-57-34-35-58-33-32-56-29-28-54-25-24-52-21-20-50-17-16-48-13-12-46-9-8-44-5-4-38(42)59-39-36(40)2-3-37(39)41/h2-35H2,1H3

Composition: C (52.95%), H (8.30%), N (1.62%), O (37.12%)

Molar Mass: 861.973

Atom Count: 130

Heavy Atom Count: 59

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 861.45694369
Formal Charge 0
FSP3 0.92
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 19
Hydrogen Bond Donor Count 0
InChIKey IHHBEUYFGWSVFO-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 210
Topological Polar Surface Area 211.36
Polarizability 83.56
Ring Count 1
Rotatable Bond Count 50

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 174569-25-6 $236.25-$779.63$236.25$519.75$779.63
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