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1-(5-CHLORO-4-NITRO-2-THIENYL)ETHAN-1-ONE

1-(5-CHLORO-4-NITRO-2-THIENYL)ETHAN-1-ONE structure

CAS No:
42456-75-7
Formula:
C6H4ClNO3S
Chemical Name:
1-(5-CHLORO-4-NITRO-2-THIENYL)ETHAN-1-ONE
Synonyms:
1-(5-CHLORO-4-NITRO-2-THIENYL)ETHAN-1-ONE;Ethanone, 1-(5-chloro-4-nitro-2-thienyl)-;1-(5-Chloro-4-nitro-thiophen-2-yl)-ethanone;1-(5-Chloro-4-Nitro-2-Thienyl)Ethan-1-One(WX636006)

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1-(5-CHLORO-4-NITRO-2-THIENYL)ETHAN-1-ONE Basic Attributes

Molecular Weight：

205.61886

Exact Mass：

204.96000

DSSTox ID：

DTXSID80334552

HScode：

2934999090

Characteristics

PSA：

91.1

XLogP3：

3.03550

Density：

1.531g/cm3

Boiling Point：

320.3ºC at 760 mmHg

Flash Point：

147.5ºC

Refractive Index：

1.602

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, 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:205.62
XLogP3:2.4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:204.9600419
Monoisotopic Mass:204.9600419
Topological Polar Surface Area:91.1
Heavy Atom Count:12
Complexity:217
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(5-CHLORO-4-NITRO-2-THIENYL)ETHAN-1-ONE

Basic Attributes
Characteristics
Safety Information
Computed Properties

1-(5-CHLORO-4-NITRO-2-THIENYL)ETHAN-1-ONE

SDS

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