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2-[4-(azepan-1-yl)but-2-ynoxy]isoindole-1,3-dione

2-[4-(azepan-1-yl)but-2-ynoxy]isoindole-1,3-dione structure

CAS No:
74484-69-8
Formula:
C18H20N2O3
Chemical Name:
2-[4-(azepan-1-yl)but-2-ynoxy]isoindole-1,3-dione
Synonyms:
BRN 5586063;2-((4-(Hexahydro-1H-azepin-1-yl)-2-butynyl)oxy)-1H-isoindole-1,3(2H)-dione;1H-Isoindole-1,3(2H)-dione, 2-((4-(hexahydro-1H-azepin-1-yl)-2-butynyl)oxy)-;CTK5D9945;DTXSID90995991;2-{[4-(Azepan-1-yl)but-2-yn-1-yl]oxy}-1H-isoindole-1,3(2H)-dione;1H-Isoindole-1,3(2H)-dione,2-[[4-(hexahydro-1H-azepin-1-yl)-2-butyn-1-yl]oxy]-

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2-[4-(azepan-1-yl)but-2-ynoxy]isoindole-1,3-dione Basic Attributes

Molecular Weight：

312.369

Exact Mass：

312.147

Characteristics

PSA：

49.8

XLogP3：

2.2

Computed Properties

Molecular Weight:312.4
XLogP3:2.2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:312.14739250
Monoisotopic Mass:312.14739250
Topological Polar Surface Area:49.8
Heavy Atom Count:23
Complexity:487
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[4-(azepan-1-yl)but-2-ynoxy]isoindole-1,3-dione

Basic Attributes
Characteristics
Computed Properties

2-[4-(azepan-1-yl)but-2-ynoxy]isoindole-1,3-dione

SDS

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