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4-(azepan-1-yl)-1-thiophen-2-ylbutan-1-one,hydrochloride

4-(azepan-1-yl)-1-thiophen-2-ylbutan-1-one,hydrochloride structure

CAS No:
143380-90-9
Formula:
C14H22ClNOS
Chemical Name:
4-(azepan-1-yl)-1-thiophen-2-ylbutan-1-one,hydrochloride
Synonyms:
1-Butanone,4-(hexahydro-1H-azepin-1-yl)-1-(2-thienyl)-,hydrochloride; 4-(azepan-1-yl)-1-thiophen-2-ylbutan-1-one hydrochloride; 4-Hexamethylenimino-1-(2-thienyl)butanone hydrochloride; 4-(Hexahydro-1H-azepin-1-yl)-1-(2-thienyl)-1-butanone hydrochloride;

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4-(azepan-1-yl)-1-thiophen-2-ylbutan-1-one,hydrochloride Basic Attributes

Molecular Weight：

287.84900

Exact Mass：

287.1110632

DSSTox ID：

DTXSID50162405

Characteristics

PSA：

48.55000

XLogP3：

4.32690

Boiling Point：

386.9ºC

Flash Point：

187.8ºC

Vapor Pressure：

3.42E-06mmHg at 25°C

Computed Properties

Molecular Weight:287.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:287.1110632
Monoisotopic Mass:287.1110632
Topological Polar Surface Area:48.6
Heavy Atom Count:18
Complexity:236
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of 4-(azepan-1-yl)-1-thiophen-2-ylbutan-1-one,hydrochloride

Basic Attributes
Characteristics
Computed Properties

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