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101015-22-9 | (4-Methyl-m-phenylenebis(iminocarbonylmethylene))bis(diethylmethylammo nium iodide)
CAS No: 101015-22-9 Catalog No: AG009RWW MDL No:
Product Description
Catalog Number:
AG009RWW
Chemical Name:
(4-Methyl-m-phenylenebis(iminocarbonylmethylene))bis(diethylmethylammo nium iodide)
CAS Number:
101015-22-9
IUPAC Name:
[2-[3-[[2-[diethyl(methyl)azaniumyl]acetyl]amino]-4-methylanilino]-2-oxoethyl]-diethyl-methylazanium;diiodide
InChI:
InChI=1S/C21H36N4O2.2HI/c1-8-24(6,9-2)15-20(26)22-18-13-12-17(5)19(14-18)23-21(27)16-25(7,10-3)11-4;;/h12-14H,8-11,15-16H2,1-7H3;2*1H
InChI Key:
XSBLQPYMMGTGKH-UHFFFAOYSA-N
Properties
Complexity:
487
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
632.108g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
632.37g/mol
Monoisotopic Mass:
632.108g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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