bis(2,5-dioxopyrrolidin-1-yl) 4,7,10,13,16,19,22,25,28,31,34-undecaoxaheptatriacontanedioate

bis(2,5-dioxopyrrolidin-1-yl) 4,7,10,13,16,19,22,25,28,31,34-undecaoxaheptatriacontanedioate

CAS: 123502-57-8

Formula: C34H56N2O19

SMILES: O=C(CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)ON1C(=O)CCC1=O)ON1C(=O)CCC1=O

IUPAC: bis(2,5-dioxopyrrolidin-1-yl) 4,7,10,13,16,19,22,25,28,31,34-undecaoxaheptatriacontanedioate

InChI: InChI=1S/C34H56N2O19/c37-29-1-2-30(38)35(29)54-33(41)5-7-43-9-11-45-13-15-47-17-19-49-21-23-51-25-27-53-28-26-52-24-22-50-20-18-48-16-14-46-12-10-44-8-6-34(42)55-36-31(39)3-4-32(36)40/h1-28H2

Composition: C (51.25%), H (7.08%), N (3.52%), O (38.15%)

Molar Mass: 796.817

Atom Count: 111

Heavy Atom Count: 55

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	796.347727591
Formal Charge	0
FSP3	0.82
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	17
Hydrogen Bond Donor Count	0
InChIKey	HOIRLEGKHJCOKZ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	186.12
Topological Polar Surface Area	228.89
Polarizability	74.19
Ring Count	2
Rotatable Bond Count	40

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