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6-amino-7-methyl-1H-purine-2-thione

6-amino-7-methyl-1H-purine-2-thione structure

CAS No:
104802-77-9
Formula:
C6H7N5S
Chemical Name:
6-amino-7-methyl-1H-purine-2-thione
Synonyms:
2-Thio-7-methyladenine; 2H-Purine-2-thione,1,7-dihydro-6-amino-7-methyl; 2-thio-6-amino-7-methylpurine; 1,7-Dihydro-6-amino-7-methyl-2H-purine-2-thione;

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6-amino-7-methyl-1H-purine-2-thione Basic Attributes

Molecular Weight：

181.21800

Exact Mass：

181.04221642

DSSTox ID：

DTXSID30146748

Characteristics

PSA：

108.42000

XLogP3：

0.81540

Density：

1.78g/cm3

Boiling Point：

271.6ºC at 760mmHg

Flash Point：

118.1ºC

Refractive Index：

1.9

Vapor Pressure：

0.00637mmHg at 25°C

Computed Properties

Molecular Weight:181.22
XLogP3:-0.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Exact Mass:181.04221642
Monoisotopic Mass:181.04221642
Topological Polar Surface Area:98.1
Heavy Atom Count:12
Complexity:340
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 6-amino-7-methyl-1H-purine-2-thione

Basic Attributes
Characteristics
Computed Properties

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