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6191-48-6 | diethyl[2-(5-ethylhexahydro-2,4,6-trioxo-5-phenylpyrimidin-2-yl)ethyl]methylammonium iodide
CAS No: 6191-48-6 Catalog No: AG00ETO4 MDL No:
Product Description
Catalog Number:
AG00ETO4
Chemical Name:
diethyl[2-(5-ethylhexahydro-2,4,6-trioxo-5-phenylpyrimidin-2-yl)ethyl]methylammonium iodide
CAS Number:
6191-48-6
IUPAC Name:
diethyl-[2-(5-ethyl-2,4,6-trioxo-5-phenyl-1,3-diazinan-1-yl)ethyl]-methylazanium;iodide
InChI:
InChI=1S/C19H27N3O3.HI/c1-5-19(15-11-9-8-10-12-15)16(23)20-18(25)21(17(19)24)13-14-22(4,6-2)7-3;/h8-12H,5-7,13-14H2,1-4H3;1H
InChI Key:
YQPJJELNEKTZSA-UHFFFAOYSA-N
EC Number:
228-237-7
Properties
Complexity:
524
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
473.118g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
473.355g/mol
Monoisotopic Mass:
473.118g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
66.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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