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

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

CAS: 1353011-78-5

Formula: C13H19BrN2O7

SMILES: BrCC(=O)NCCOCCOCCC(=O)ON1C(=O)CCC1=O

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

InChI: InChI=1S/C13H19BrN2O7/c14-9-10(17)15-4-6-22-8-7-21-5-3-13(20)23-16-11(18)1-2-12(16)19/h1-9H2,(H,15,17)

Composition: C (39.51%), H (4.85%), Br (20.22%), N (7.09%), O (28.34%)

Molar Mass: 395.206

Atom Count: 42

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	394.037564
Formal Charge	0
FSP3	0.69
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
InChIKey	HDIXVXMKIWXBFA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	80.52
Topological Polar Surface Area	111.24
Polarizability	31.81
Ring Count	1
Rotatable Bond Count	12

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<2 Days	1353011-78-5		$434.70-$2,126.25$434.70$867.51$1,417.50$2,126.25