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Home > Nitro Compounds > 75321-09-4
75321-09-4 | Magnesium 4-Nitrobenzyl Malonate Hydrate,
CAS No: 75321-09-4 Catalog No: AG003RED MDL No:
Product Description
Catalog Number:
AG003RED
Chemical Name:
Magnesium 4-Nitrobenzyl Malonate Hydrate,
CAS Number:
75321-09-4
IUPAC Name:
magnesium;3-[(4-nitrophenyl)methoxy]-3-oxopropanoate;hydrate
InChI:
InChI=1S/2C10H9NO6.Mg.H2O/c2*12-9(13)5-10(14)17-6-7-1-3-8(4-2-7)11(15)16;;/h2*1-4H,5-6H2,(H,12,13);;1H2/q;;+2;/p-2
InChI Key:
YBYPQJVVTJGLIW-UHFFFAOYSA-L
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
4
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
518.066g/mol
Formal Charge:
0
Heavy Atom Count:
36
Hydrogen Bond Acceptor Count:
13
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
518.67g/mol
Monoisotopic Mass:
518.066g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
226A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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