3-{2-[2-(methylamino)ethoxy]ethoxy}propanoic acid

3-{2-[2-(methylamino)ethoxy]ethoxy}propanoic acid

CAS: 1807503-87-2

Formula: C8H17NO4

SMILES: CNCCOCCOCCC(O)=O

IUPAC: 3-{2-[2-(methylamino)ethoxy]ethoxy}propanoic acid

InChI: InChI=1S/C8H17NO4/c1-9-3-5-13-7-6-12-4-2-8(10)11/h9H,2-7H2,1H3,(H,10,11)

Composition: C (50.25%), H (8.96%), N (7.32%), O (33.47%)

Molar Mass: 191.227

Atom Count: 30

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	191.115758031
Formal Charge	0
FSP3	0.87
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	NZAMTZREVKICMJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.56
Topological Polar Surface Area	67.79
Polarizability	18.96
Ring Count	0
Rotatable Bond Count	9

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