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6291-95-8 | 1,3,5-Tris(2-methylallyl);-1,3,5-triazinane-2,4,6-trione
CAS No: 6291-95-8 Catalog No: AG003DGQ MDL No:
Product Description
Catalog Number:
AG003DGQ
Chemical Name:
1,3,5-Tris(2-methylallyl);-1,3,5-triazinane-2,4,6-trione
CAS Number:
6291-95-8
Molecular Formula:
C15H21N3O3
Molecular Weight:
291.3455
IUPAC Name:
1,3,5-tris(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione
InChI:
InChI=1S/C15H21N3O3/c1-10(2)7-16-13(19)17(8-11(3)4)15(21)18(14(16)20)9-12(5)6/h1,3,5,7-9H2,2,4,6H3
InChI Key:
MPJPKEMZYOAIRN-UHFFFAOYSA-N
SMILES:
CC(=C)Cn1c(=O)n(CC(=C)C)c(=O)n(c1=O)CC(=C)C
UNII:
8MLN0C258T
Properties
Complexity:
436
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.158g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.351g/mol
Monoisotopic Mass:
291.158g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
60.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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