Text Search
Structure Search

3-({2-[(2-carboxyethyl)(carboxymethyl)amino]ethyl}(carboxymethyl)amino)propanoic acid

3-({2-[(2-carboxyethyl)(carboxymethyl)amino]ethyl}(carboxymethyl)amino)propanoic acid

CAS: 32701-19-2

Formula: C12H20N2O8

SMILES: OC(=O)CCN(CCN(CCC(O)=O)CC(O)=O)CC(O)=O

IUPAC: 3-({2-[(2-carboxyethyl)(carboxymethyl)amino]ethyl}(carboxymethyl)amino)propanoic acid

InChI: InChI=1S/C12H20N2O8/c15-9(16)1-3-13(7-11(19)20)5-6-14(8-12(21)22)4-2-10(17)18/h1-8H2,(H,15,16)(H,17,18)(H,19,20)(H,21,22)

Composition: C (45.00%), H (6.29%), N (8.75%), O (39.96%)

Molar Mass: 320.298

Atom Count: 42

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 320.121965612
Formal Charge 0
FSP3 0.67
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 10
Hydrogen Bond Donor Count 4
InChIKey IZQWNOQOAFSHOK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 71.74
Topological Polar Surface Area 155.68
Polarizability 28.3
Ring Count 0
Rotatable Bond Count 13

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime CAS UnitPrice
98% <14 Days 32701-19-2 Quote Only