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2,5-dioxopyrrolidin-1-yl 4-azidobenzoate

2,5-dioxopyrrolidin-1-yl 4-azidobenzoate

CAS: 53053-08-0

Formula: C11H8N4O4

SMILES: [N-]=[N+]=NC1=CC=C(C=C1)C(=O)ON1C(=O)CCC1=O

IUPAC: 2,5-dioxopyrrolidin-1-yl 4-azidobenzoate

InChI: InChI=1S/C11H8N4O4/c12-14-13-8-3-1-7(2-4-8)11(18)19-15-9(16)5-6-10(15)17/h1-4H,5-6H2

Composition: C (50.77%), H (3.10%), N (21.53%), O (24.59%)

Molar Mass: 260.209

Atom Count: 27

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 260.054554754
Formal Charge 0
FSP3 0.18
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
InChIKey LWAVGNJLLQSNNN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 64.16
Topological Polar Surface Area 93.11
Polarizability 23.24
Ring Count 2
Rotatable Bond Count 4

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