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9-benzyl-2-chloro-6-(trifluoromethyl)purine

9-benzyl-2-chloro-6-(trifluoromethyl)purine structure

CAS No:
1682-16-2
Formula:
C13H8ClF3N4
Chemical Name:
9-benzyl-2-chloro-6-(trifluoromethyl)purine
Synonyms:
9-Benzyl-2-chlor-6-trifluormethyl-purin;

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9-benzyl-2-chloro-6-(trifluoromethyl)purine Basic Attributes

Molecular Weight：

312.67800

Exact Mass：

312.0389585 g/mol

NSC Number：

63341

DSSTox ID：

DTXSID30289745

Characteristics

PSA：

43.60000

XLogP3：

3.54680

Density：

1.52g/cm3

Boiling Point：

375.5ºC

Flash Point：

180.9ºC

Refractive Index：

1.628

Vapor Pressure：

7.76E-06mmHg at 25°C

Computed Properties

Molecular Weight:312.68
XLogP3:3.5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:312.0389585
Monoisotopic Mass:312.0389585
Topological Polar Surface Area:43.6
Heavy Atom Count:21
Complexity:362
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 9-benzyl-2-chloro-6-(trifluoromethyl)purine

Basic Attributes
Characteristics
Computed Properties

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