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9-benzyl-2-chloro-N-(3-fluorophenyl)purin-6-amine

9-benzyl-2-chloro-N-(3-fluorophenyl)purin-6-amine structure

CAS No:
125802-62-2
Formula:
C18H13ClFN5
Chemical Name:
9-benzyl-2-chloro-N-(3-fluorophenyl)purin-6-amine
Synonyms:
9H-Purin-6-amine,2-chloro-N-(3-fluorophenyl)-9-(phenylmethyl);

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9-benzyl-2-chloro-N-(3-fluorophenyl)purin-6-amine Basic Attributes

Molecular Weight：

353.78100

Exact Mass：

353.0843513

Characteristics

PSA：

55.63000

XLogP3：

4.48370

Density：

1.41g/cm3

Boiling Point：

497.5ºC

Flash Point：

254.7ºC

Refractive Index：

1.693

Vapor Pressure：

4.93E-10mmHg at 25°C

Computed Properties

Molecular Weight:353.8
XLogP3:4.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:353.0843513
Monoisotopic Mass:353.0843513
Topological Polar Surface Area:55.6
Heavy Atom Count:25
Complexity:436
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 9-benzyl-2-chloro-N-(3-fluorophenyl)purin-6-amine

Basic Attributes
Characteristics
Computed Properties

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