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7-methoxy-5,8-dioxoisoquinoline-1-carbonitrile

7-methoxy-5,8-dioxoisoquinoline-1-carbonitrile structure

CAS No:
97581-10-7
Formula:
C11H6N2O3
Chemical Name:
7-methoxy-5,8-dioxoisoquinoline-1-carbonitrile
Synonyms:
1-Cyano-7-methoxy-5,8-dihydroisoquinoline-5,8-dione;97581-10-7;7-methoxy-5,8-dioxo-isoquinoline-1-carbonitrile;5,8-Dihydro-7-methoxy-5,8-dioxo-1-isoquinolinecarbonitrile

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7-methoxy-5,8-dioxoisoquinoline-1-carbonitrile Basic Attributes

Molecular Weight：

214.18 g/mol

Exact Mass：

214.03784206 g/mol

Characteristics

PSA：

80 Å²

XLogP3：

0.86258

Melting Point：

242.5 - 243.5 °C (diethyl ether)

Computed Properties

Molecular Weight:214.18
XLogP3:0.6
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:214.03784206
Monoisotopic Mass:214.03784206
Topological Polar Surface Area:80
Heavy Atom Count:16
Complexity:418
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Synthesis Route

97581-25-4

97581-10-7

Hot Searches: smz-tmp; sicl4; t butyl alcohol; ambroxol; hydrogenated castor oil; potassium sulfide formula

Guide of 7-methoxy-5,8-dioxoisoquinoline-1-carbonitrile

Basic Attributes
Characteristics
Computed Properties
Synthesis Route

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