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9-(4-chlorobut-2-ynyl)purin-6-amine

9-(4-chlorobut-2-ynyl)purin-6-amine structure

CAS No:
114987-15-4
Formula:
C9H8ClN5
Chemical Name:
9-(4-chlorobut-2-ynyl)purin-6-amine
Synonyms:
9-(4-Chloro-2-butyn)-adenine;ClCH2C#C-CH2-adenine;114987-15-4;N9-(4-Chloro-2-butyn-1-yl)adenine;9-(4-chlorobut-2-ynyl)purin-6-amine;CHEMBL135806;DTXSID50150908

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9-(4-chlorobut-2-ynyl)purin-6-amine Basic Attributes

Molecular Weight：

221.64 g/mol

Exact Mass：

221.0468230 g/mol

DSSTox ID：

DTXSID50150908

Characteristics

PSA：

69.6 Å²

Computed Properties

Molecular Weight:221.64
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:221.0468230
Monoisotopic Mass:221.0468230
Topological Polar Surface Area:69.6
Heavy Atom Count:15
Complexity:283
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 9-(4-chlorobut-2-ynyl)purin-6-amine

Basic Attributes
Characteristics
Computed Properties

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