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4-Methyl-2H-isoquinolin-1-one

4-Methyl-2H-isoquinolin-1-one structure

CAS No:
77077-83-9
Formula:
C10H9NO
Chemical Name:
4-Methyl-2H-isoquinolin-1-one
Synonyms:
4-Methyl-2H-isoquinolin-1-one;4-methyl-1(2H)-Isoquinolinone;4-methyl-1,2-dihydroisoquinolin-1-one;1(2H)-Isoquinolinone, 4-methyl-

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4-Methyl-2H-isoquinolin-1-one Basic Attributes

Molecular Weight：

159.18

Exact Mass：

159.068413911

DSSTox ID：

DTXSID80507148

Characteristics

PSA：

32.86000

XLogP3：

1.83650

Density：

1.136±0.06 g/cm3

Melting Point：

172-173 °C

Boiling Point：

371.7±35.0 °C(Predicted)

PKA：

13.65±0.40

Computed Properties

Molecular Weight:159.18
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Exact Mass:159.068413911
Monoisotopic Mass:159.068413911
Topological Polar Surface Area:29.1
Heavy Atom Count:12
Complexity:232
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-Methyl-2H-isoquinolin-1-one

Basic Attributes
Characteristics
Computed Properties

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