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8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione

8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione structure

CAS No:
111038-25-6
Formula:
C10H15N5O4
Chemical Name:
8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione
Synonyms:
1H-Purine-2,6-dione,8-amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-;8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione

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8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione Basic Attributes

Molecular Weight：

269.261

Exact Mass：

269.26

Characteristics

PSA：

125

XLogP3：

-2.2

Density：

1.70±0.1 g/cm3(Predicted)

Melting Point：

242-243 °C @ Solvent: Methanol

Boiling Point：

623.7±65.0 °C(Predicted)

Flash Point：

331ºC

Refractive Index：

1.735

Vapor Pressure：

2.02E-16mmHg at 25°C

Computed Properties

Molecular Weight:269.26
XLogP3:-2.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:269.11240398
Monoisotopic Mass:269.11240398
Topological Polar Surface Area:125
Heavy Atom Count:19
Complexity:392
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione

Basic Attributes
Characteristics
Computed Properties

8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione

SDS

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