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4-[2-(3,4-dihydro-2(1H)-isoquinolinyl)ethoxy]benzonitrile

4-[2-(3,4-dihydro-2(1H)-isoquinolinyl)ethoxy]benzonitrile structure

CAS No:
723248-81-5
Formula:
C18H18N2O
Chemical Name:
4-[2-(3,4-dihydro-2(1H)-isoquinolinyl)ethoxy]benzonitrile
Synonyms:
MLS001180219;4-[2-(3,4-dihydro-2(1H)-isoquinolinyl)ethoxy]benzonitrile;SMR000476498;AJ-292/42546156;cid_901228;CHEMBL1704911;BDBM72797;4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethoxy]benzonitrile;HMS2790A03;ZINC19815393

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4-[2-(3,4-dihydro-2(1H)-isoquinolinyl)ethoxy]benzonitrile Basic Attributes

Molecular Weight：

278.34832

Exact Mass：

278.142

Characteristics

PSA：

36.3

XLogP3：

3.2

Water Solubility：

41 [ug/mL]

Computed Properties

Molecular Weight:278.3
XLogP3:3.2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:278.141913202
Monoisotopic Mass:278.141913202
Topological Polar Surface Area:36.3
Heavy Atom Count:21
Complexity:367
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-[2-(3,4-dihydro-2(1H)-isoquinolinyl)ethoxy]benzonitrile

Basic Attributes
Characteristics
Computed Properties

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