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1-Azepan-1-yl-2-chloro-ethanone

1-Azepan-1-yl-2-chloro-ethanone structure

CAS No:
52227-33-5
Formula:
C8H14ClNO
Chemical Name:
1-Azepan-1-yl-2-chloro-ethanone
Synonyms:
1-Azepan-1-yl-2-chloro-ethanone;1H-azepine, 1-(chloroacetyl)hexahydro-;1-(chloroacetyl)azepane(SALTDATA: FREE);1-(1-azepanyl)-2-chloroethanone

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1-Azepan-1-yl-2-chloro-ethanone Basic Attributes

Molecular Weight：

175.66

Exact Mass：

175.07600

DSSTox ID：

DTXSID70389773

HScode：

2933990090

Characteristics

PSA：

20.3

XLogP3：

1.56570

Density：

1.112g/cm3

Boiling Point：

287.8ºC at 760 mmHg

Flash Point：

127.9ºC

Refractive Index：

1.485

Safety Information

Hazard category：

IRRITANT

GHS Classification：

|Danger|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:175.65
XLogP3:1.5
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:175.0763918
Monoisotopic Mass:175.0763918
Topological Polar Surface Area:20.3
Heavy Atom Count:11
Complexity:130
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-Azepan-1-yl-2-chloro-ethanone

Basic Attributes
Characteristics
Safety Information
Computed Properties

1-Azepan-1-yl-2-chloro-ethanone

SDS

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