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2-(4-methoxyphenyl)isoquinolin-2-ium-4-olate

2-(4-methoxyphenyl)isoquinolin-2-ium-4-olate structure

CAS No:
56359-30-9
Formula:
C16H13NO2
Chemical Name:
2-(4-methoxyphenyl)isoquinolin-2-ium-4-olate
Synonyms:
Isoquinolinium, 4-hydroxy-2-(4-methoxyphenyl)hydroxide, inner salt;56359-30-9;DTXSID30204913

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2-(4-methoxyphenyl)isoquinolin-2-ium-4-olate Basic Attributes

Molecular Weight：

251.28 g/mol

Exact Mass：

251.094628657 g/mol

DSSTox ID：

DTXSID30204913

Characteristics

PSA：

36.2 Å²

Computed Properties

Molecular Weight:251.28
XLogP3:4.2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:251.094628657
Monoisotopic Mass:251.094628657
Topological Polar Surface Area:36.2
Heavy Atom Count:19
Complexity:289
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(4-methoxyphenyl)isoquinolin-2-ium-4-olate

Basic Attributes
Characteristics
Computed Properties

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