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8-Chloro-3,9-dihydro-1H-purine-2,6-dione

8-Chloro-3,9-dihydro-1H-purine-2,6-dione structure

CAS No:
13548-68-0
Formula:
C5H3ClN4O2
Chemical Name:
8-Chloro-3,9-dihydro-1H-purine-2,6-dione
Synonyms:
1H-Purine-2,6-dione,8-chloro-3,9-dihydro-;Xanthine,8-chloro-;1H-Purine-2,6-dione,8-chloro-3,7-dihydro-;8-Chloro-3,9-dihydro-1H-purine-2,6-dione;8-Chloroxanthine;NSC 45762;8-Chloropurine-2,6-diol

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Description

Solid

8-Chloroxanthine is an oxopurine.

8-Chloro-3,9-dihydro-1H-purine-2,6-dione Basic Attributes

Molecular Weight：

186.56

Exact Mass：

186.56

NSC Number：

45762

HScode：

2933990090

Characteristics

PSA：

86.9

XLogP3：

0.2

Density：

1.779±0.06 g/cm3(Predicted)

Refractive Index：

1.987

Water Solubility：

0.167 mg/mL at 20 °C

Computed Properties

Molecular Weight:186.55
XLogP3:0.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Exact Mass:185.9944530
Monoisotopic Mass:185.9944530
Topological Polar Surface Area:86.9
Heavy Atom Count:12
Complexity:246
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: tert-butanol; acid capric; chromate charge; monoammonium phosphate; ammonium formula; hongdenafil

Guide of 8-Chloro-3,9-dihydro-1H-purine-2,6-dione

Description
Basic Attributes
Characteristics
Computed Properties

8-Chloro-3,9-dihydro-1H-purine-2,6-dione

SDS

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