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(5E)-5-(dimethylaminomethylidene)-3-oxo-2,6,7,8-tetrahydroisoquinoline -4-carbonitrile

(5E)-5-(dimethylaminomethylidene)-3-oxo-2,6,7,8-tetrahydroisoquinoline -4-carbonitrile structure

CAS No:
128767-22-6
Formula:
C13H15N3O
Chemical Name:
(5E)-5-(dimethylaminomethylidene)-3-oxo-2,6,7,8-tetrahydroisoquinoline -4-carbonitrile
Synonyms:
4-Isoquinolinecarbonitrile,5-[(dimethylamino)methylene]-2,3,5,6,7,8-hexahydro-3-oxo-;ACMC-20msyu;CTK4B6054

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(5E)-5-(dimethylaminomethylidene)-3-oxo-2,6,7,8-tetrahydroisoquinoline -4-carbonitrile Basic Attributes

Molecular Weight：

229.283

Exact Mass：

229.122

Characteristics

PSA：

56.1

XLogP3：

0.2

Computed Properties

Molecular Weight:229.28
XLogP3:0.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:229.121512110
Monoisotopic Mass:229.121512110
Topological Polar Surface Area:56.1
Heavy Atom Count:17
Complexity:500
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (5E)-5-(dimethylaminomethylidene)-3-oxo-2,6,7,8-tetrahydroisoquinoline -4-carbonitrile

Basic Attributes
Characteristics
Computed Properties

(5E)-5-(dimethylaminomethylidene)-3-oxo-2,6,7,8-tetrahydroisoquinoline -4-carbonitrile

SDS

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