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1,3,7-trimethyl-8-[5-(1,3,7-trimethyl-2,6-dioxopurin-8-yl)pentyl]purine-2,6-dione

1,3,7-trimethyl-8-[5-(1,3,7-trimethyl-2,6-dioxopurin-8-yl)pentyl]purine-2,6-dione structure

CAS No:
5426-93-7
Formula:
C21H28N8O4
Chemical Name:
1,3,7-trimethyl-8-[5-(1,3,7-trimethyl-2,6-dioxopurin-8-yl)pentyl]purine-2,6-dione
Synonyms:
1H-Purine-2,6-dione,8,8'-(1,5-pentanediyl)bis(3,7-dihydro-1,3,7-trimethyl; 8,8'-pentane-1,5-diylbis(1,3,7-trimethyl-3,7-dihydro-1h-purine-2,6-dione);

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1,3,7-trimethyl-8-[5-(1,3,7-trimethyl-2,6-dioxopurin-8-yl)pentyl]purine-2,6-dione Basic Attributes

Molecular Weight：

456.49800

Exact Mass：

456.22335140 g/mol

UNII：

U5M98U6PD4

NSC Number：

14416

DSSTox ID：

DTXSID80202621

Characteristics

PSA：

123.64000

XLogP3：

-0.78970

Density：

1.45g/cm3

Boiling Point：

726.4ºC

Flash Point：

393.1ºC

Refractive Index：

1.698

Computed Properties

Molecular Weight:456.5
XLogP3:0.8
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:456.22335140
Monoisotopic Mass:456.22335140
Topological Polar Surface Area:117
Heavy Atom Count:33
Complexity:773
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: sulfuryl fluoride; zinc carbonate; lithium acetate; diphosphorus pentoxide; quinone; ammonium sulfide formula

Guide of 1,3,7-trimethyl-8-[5-(1,3,7-trimethyl-2,6-dioxopurin-8-yl)pentyl]purine-2,6-dione

Basic Attributes
Characteristics
Computed Properties

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