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2,5-dioxopyrrolidin-1-yl 2,5,8,11,14,17,20,23,26,29,32-undecaoxapentatriacontan-35-oate

2,5-dioxopyrrolidin-1-yl 2,5,8,11,14,17,20,23,26,29,32-undecaoxapentatriacontan-35-oate

CAS: 174569-25-6

Formula: C28H51NO15

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

IUPAC: 2,5-dioxopyrrolidin-1-yl 2,5,8,11,14,17,20,23,26,29,32-undecaoxapentatriacontan-35-oate

InChI: InChI=1S/C28H51NO15/c1-33-6-7-35-10-11-37-14-15-39-18-19-41-22-23-43-25-24-42-21-20-40-17-16-38-13-12-36-9-8-34-5-4-28(32)44-29-26(30)2-3-27(29)31/h2-25H2,1H3

Composition: C (52.41%), H (8.01%), N (2.18%), O (37.40%)

Molar Mass: 641.708

Atom Count: 95

Heavy Atom Count: 44

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 641.325869946
Formal Charge 0
FSP3 0.89
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 14
Hydrogen Bond Donor Count 0
InChIKey HYDAGTBASRKVKQ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 154.79
Topological Polar Surface Area 165.21
Polarizability 61.6
Ring Count 1
Rotatable Bond Count 35

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