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4408-81-5 | 1,2-Diaminopropane-N,N,N,N-tetraacetic acid
CAS No: 4408-81-5 Catalog No: AG003DDF MDL No:MFCD00004286
Product Description
Catalog Number:
AG003DDF
Chemical Name:
1,2-Diaminopropane-N,N,N,N-tetraacetic acid
CAS Number:
4408-81-5
Molecular Formula:
C11H18N2O8
Molecular Weight:
306.2692
MDL Number:
MFCD00004286
IUPAC Name:
2-[2-[bis(carboxymethyl)amino]propyl-(carboxymethyl)amino]acetic acid
InChI:
InChI=1S/C11H18N2O8/c1-7(13(5-10(18)19)6-11(20)21)2-12(3-8(14)15)4-9(16)17/h7H,2-6H2,1H3,(H,14,15)(H,16,17)(H,18,19)(H,20,21)
InChI Key:
XNCSCQSQSGDGES-UHFFFAOYSA-N
SMILES:
OC(=O)CN(CC(N(CC(=O)O)CC(=O)O)C)CC(=O)O
EC Number:
224-559-7
NSC Number:
132341
Properties
Complexity:
379
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.106g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
306.271g/mol
Monoisotopic Mass:
306.106g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
156A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-5.4
Literature
| Title | Journal |
|---|---|
| Thermodynamic and structural study of phenanthroline derivative ruthenium complex/DNA interactions: probing partial intercalation and binding properties. | Journal of inorganic biochemistry 20120101 |
| Synthesis and characterization of polymer eight-coordinate (enH2)[YIII(pdta)(H2O)](2)·10H2O as well as the interaction of [YIII(pdta)(H2O)]2(2-) with BSA. | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20101201 |
| Improving sensitivity in simultaneous determination of copper carboxylates by nonaqueous capillary electrophoresis. | Journal of chromatography. A 20060331 |
| A novel ternary ligand system useful for preparation of cationic (99m)Tc-diazenido complexes and (99m)Tc-labeling of small biomolecules. | Bioconjugate chemistry 20060101 |
| Occurrence of aminopolycarboxylates in the aquatic environment of Germany. | Environmental pollution (Barking, Essex : 1987) 20040901 |
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