Home Carboxys 3,12-Bis(carboxymethyl)-6,9-dioxa-3,12-diazatetradecane-1,14-dioic acid, tetrasodium salt

3,12-Bis(carboxymethyl)-6,9-dioxa-3,12-diazatetradecane-1,14-dioic acid, tetrasodium salt

CAS No.:
13368-13-3
Catalog Number:
AG003PX2
Molecular Formula:
C14H20N2Na4O10
Molecular Weight:
468.2751
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Product Description
Catalog Number:
AG003PX2
Chemical Name:
3,12-Bis(carboxymethyl)-6,9-dioxa-3,12-diazatetradecane-1,14-dioic acid, tetrasodium salt
CAS Number:
13368-13-3
Molecular Formula:
C14H20N2Na4O10
Molecular Weight:
468.2751
MDL Number:
MFCD00274420
IUPAC Name:
tetrasodium;2-[2-[2-[2-[bis(carboxylatomethyl)amino]ethoxy]ethoxy]ethyl-(carboxylatomethyl)amino]acetate
InChI:
InChI=1S/C14H24N2O10.4Na/c17-11(18)7-15(8-12(19)20)1-3-25-5-6-26-4-2-16(9-13(21)22)10-14(23)24;;;;/h1-10H2,(H,17,18)(H,19,20)(H,21,22)(H,23,24);;;;/q;4*+1/p-4
InChI Key:
BAOGCDPNNOBWQZ-UHFFFAOYSA-J
SMILES:
[O-]C(=O)CN(CC(=O)[O-])CCOCCOCCN(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Na+].[Na+]
Properties
Complexity:
375  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
5  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
468.071g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
468.277g/mol
Monoisotopic Mass:
468.071g/mol
Rotatable Bond Count:
13  
Topological Polar Surface Area:
186A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties