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173357-17-0 | Glycine, N,N-bis[2-[2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethoxy]-2-oxoethyl]-, sodium salt (1:1)
CAS No: 173357-17-0 Catalog No: AG001YTP MDL No:MFCD24369580
Product Description
Catalog Number:
AG001YTP
Chemical Name:
Glycine, N,N-bis[2-[2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethoxy]-2-oxoethyl]-, sodium salt (1:1)
CAS Number:
173357-17-0
Molecular Formula:
C18H22N7NaO10
Molecular Weight:
519.3979
MDL Number:
MFCD24369580
IUPAC Name:
sodium;2-[bis[2-[2-(2-methyl-5-nitroimidazol-1-yl)ethoxy]-2-oxoethyl]amino]acetate
InChI:
InChI=1S/C18H23N7O10.Na/c1-12-19-7-14(24(30)31)22(12)3-5-34-17(28)10-21(9-16(26)27)11-18(29)35-6-4-23-13(2)20-8-15(23)25(32)33;/h7-8H,3-6,9-11H2,1-2H3,(H,26,27);/q;+1/p-1
InChI Key:
FWYUJENICVGSJH-UHFFFAOYSA-M
SMILES:
[O-]C(=O)CN(CC(=O)OCCn1c(C)ncc1[N+](=O)[O-])CC(=O)OCCn1c(C)ncc1[N+](=O)[O-].[Na+]
UNII:
5YV419FIJS
Properties
Complexity:
727
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
519.133g/mol
Formal Charge:
0
Heavy Atom Count:
36
Hydrogen Bond Acceptor Count:
13
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
519.403g/mol
Monoisotopic Mass:
519.133g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
223A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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