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Nitrilotriacetic acid

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Description
Nitrilotriacetic acid (Nitriloacetate) is a chelator that tracks and enriches His-tagged proteins in living cells by reacting with divalent metal ions-mediated 6His tagging.
CAS Number
139-13-9
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
191.14
Molecular Formula
C6H9NO6
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

Nitrilotriacetic Acid

Nitrilotriacetic Acid can cause cancer according to an independent committee of scientific and health experts.

CAS Number139-13-9
PubChem CID8758
IUPAC Name2-[bis(carboxymethyl)amino]acetic acid
Molecular FormulaC6H9NO6
Molecular Weight191.14
XLogP-3.2
Topological Polar Surface Area115
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Heavy Atom Count13
Formal Charge0
Complexity187
SMILES
C(C(=O)O)N(CC(=O)O)CC(=O)O
InChI
InChI=1S/C6H9NO6/c8-4(9)1-7(2-5(10)11)3-6(12)13/h1-3H2,(H,8,9)(H,10,11)(H,12,13)
InChIKey
MGFYIUFZLHCRTH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Nitrilotriacetic Acid
CAS: 139-13-9
CID: 8758
Formula: C6H9NO6
MW: 191.14
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight191.14
XLogP3-3.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Exact Mass191.04298701
Monoisotopic Mass191.04298701
Topological Polar Surface Area115 Ų
Heavy Atom Count13
Formal Charge0
Complexity187
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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