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3-(6-aminopurin-9-yl)propanenitrile

3-(6-aminopurin-9-yl)propanenitrile structure

CAS No:
4244-45-5
Formula:
C8H8N6
Chemical Name:
3-(6-aminopurin-9-yl)propanenitrile
Synonyms:
3-(6-amino-9h-purin-9-yl)propanenitrile;4244-45-5;3-(6-aminopurin-9-yl)propanenitrile;3-(6-aminopurin-9-yl)propionitrile;NSC79668;N9-(cyanoethyl)adenine;9-(2-Cyanoethyl)adenine;NCIOpen2_000908;SCHEMBL6692351;DTXSID50292019;ZINC1724219;6-Amino-9H-purine-9-propanenitrile;NSC-79668;AKOS004910221;DS-013862;AO-801/41077552

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3-(6-aminopurin-9-yl)propanenitrile Basic Attributes

Molecular Weight：

188.19 g/mol

Exact Mass：

188.08104428 g/mol

NSC Number：

79668

DSSTox ID：

DTXSID50292019

Characteristics

PSA：

93.4 Å²

Computed Properties

Molecular Weight:188.19
XLogP3:-0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:188.08104428
Monoisotopic Mass:188.08104428
Topological Polar Surface Area:93.4
Heavy Atom Count:14
Complexity:246
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(6-aminopurin-9-yl)propanenitrile

Basic Attributes
Characteristics
Computed Properties

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