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1,3,4(2H)-Isoquinolinetrione

1,3,4(2H)-Isoquinolinetrione structure

CAS No:
521-73-3
Formula:
C9H5NO3
Chemical Name:
1,3,4(2H)-Isoquinolinetrione
Synonyms:
1,3,4(2H)-Isoquinolinetrione;Phthalonimide;Isoquinoline-1,3,4-trione;NSC 407248

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1,3,4(2H)-Isoquinolinetrione Basic Attributes

Molecular Weight：

175.143

Exact Mass：

175.14

UNII：

BM68CV5X6Q

NSC Number：

407248

DSSTox ID：

DTXSID40200103

HScode：

2933499090

Characteristics

PSA：

63.2

XLogP3：

0.27

Density：

1.4±0.1 g/cm3

Melting Point：

228-229 °C

Refractive Index：

1.609

Drug Information

MeSH Entry Terms：

isoquinoline-1,3,4-trione

Computed Properties

Molecular Weight:175.14
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Exact Mass:175.026943022
Monoisotopic Mass:175.026943022
Topological Polar Surface Area:63.2
Heavy Atom Count:13
Complexity:285
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,3,4(2H)-Isoquinolinetrione

Basic Attributes
Characteristics
Drug Information
Computed Properties

1,3,4(2H)-Isoquinolinetrione

SDS

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