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7H-Purine-7-ethanaminium, N,N-diethyl-1,2,3,6-tetrahydro-N,1,3-trimethyl-2,6-dioxo-, iodide (1:1)

7H-Purine-7-ethanaminium, N,N-diethyl-1,2,3,6-tetrahydro-N,1,3-trimethyl-2,6-dioxo-, iodide (1:1) structure

CAS No:
35206-03-2
Formula:
C14H24N5O2.I
Chemical Name:
7H-Purine-7-ethanaminium, N,N-diethyl-1,2,3,6-tetrahydro-N,1,3-trimethyl-2,6-dioxo-, iodide (1:1)
Synonyms:
7H-Purine-7-ethanaminium,N,N-diethyl-1,2,3,6-tetrahydro-N,1,3-trimethyl-2,6-dioxo-,iodide (1:1);7H-Purine-7-ethanaminium,N,N-diethyl-1,2,3,6-tetrahydro-N,1,3-trimethyl-2,6-dioxo-,iodide;Etamiphyllin methiodide;Simesphylline

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7H-Purine-7-ethanaminium, N,N-diethyl-1,2,3,6-tetrahydro-N,1,3-trimethyl-2,6-dioxo-, iodide (1:1) Basic Attributes

Molecular Weight：

421.28 g/mol

Exact Mass：

421.09747 g/mol

EC Number：

252-437-3

UNII：

4VSE9SD62R

DSSTox ID：

DTXSID60188712

Characteristics

PSA：

58.4 Å²

Melting Point：

234 °C

Computed Properties

Molecular Weight:421.28
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:421.09747
Monoisotopic Mass:421.09747
Topological Polar Surface Area:58.4
Heavy Atom Count:22
Complexity:424
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of 7H-Purine-7-ethanaminium, N,N-diethyl-1,2,3,6-tetrahydro-N,1,3-trimethyl-2,6-dioxo-, iodide (1:1)

Basic Attributes
Characteristics
Computed Properties

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