2,5-dioxopyrrolidin-1-yl 3-{2-[2-(prop-2-yn-1-yloxy)ethoxy]ethoxy}propanoate

2,5-dioxopyrrolidin-1-yl 3-{2-[2-(prop-2-yn-1-yloxy)ethoxy]ethoxy}propanoate

CAS: 1428629-71-3

Formula: C14H19NO7

SMILES: O=C(CCOCCOCCOCC#C)ON1C(=O)CCC1=O

IUPAC: 2,5-dioxopyrrolidin-1-yl 3-{2-[2-(prop-2-yn-1-yloxy)ethoxy]ethoxy}propanoate

InChI: InChI=1S/C14H19NO7/c1-2-6-19-8-10-21-11-9-20-7-5-14(18)22-15-12(16)3-4-13(15)17/h1H,3-11H2

Composition: C (53.67%), H (6.11%), N (4.47%), O (35.75%)

Molar Mass: 313.306

Atom Count: 41

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	313.116151956
Formal Charge	0
FSP3	0.64
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
InChIKey	YDRPXORAOIYIGV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	74.02
Topological Polar Surface Area	91.37
Polarizability	29.03
Ring Count	1
Rotatable Bond Count	12

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