2,5-dioxopyrrolidin-1-yl 1-azido-3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51,54,57,60,63,66,69,72-tetracosaoxapentaheptacontan-75-oate

2,5-dioxopyrrolidin-1-yl 1-azido-3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51,54,57,60,63,66,69,72-tetracosaoxapentaheptacontan-75-oate

CAS: 2375600-46-51108750-59-9

Formula: C55H104N4O28

SMILES: [N-]=[N+]=NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)ON1C(=O)CCC1=O

IUPAC: 2,5-dioxopyrrolidin-1-yl 1-azido-3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51,54,57,60,63,66,69,72-tetracosaoxapentaheptacontan-75-oate

InChI: InChI=1S/C55H104N4O28/c56-58-57-4-6-64-8-10-66-12-14-68-16-18-70-20-22-72-24-26-74-28-30-76-32-34-78-36-38-80-40-42-82-44-46-84-48-50-86-52-51-85-49-47-83-45-43-81-41-39-79-37-35-77-33-31-75-29-27-73-25-23-71-21-19-69-17-15-67-13-11-65-9-7-63-5-3-55(62)87

Composition: C (52.04%), H (8.26%), N (4.41%), O (35.29%)

Molar Mass: 1269.437

Atom Count: 191

Heavy Atom Count: 87

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	1268.683708725
Formal Charge	0
FSP3	0.95
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	29
Hydrogen Bond Donor Count	0
InChIKey	MGAQCNKHLTVSCR-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	310.94
Topological Polar Surface Area	314.63
Polarizability	122.89
Ring Count	1
Rotatable Bond Count	77

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