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

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

CAS No:
2160-55-6
Formula:
C6H4BrNO3S
Chemical Name:
1-(5-BROMO-4-NITRO-2-THIENYL)ETHAN-1-ONE
Synonyms:
1-(5-Bromo-4-nitro-2-thienyl)ethan-1-one;1-(5-bromo-4-nitrothiophen-2-yl)ethanone;2-Acetyl-5-bromo-4-nitrothiophene;1-(5-bromo-4-nitrothiophen-2-yl)ethan-1-one;SCHEMBL11259653;CTK0I9258;DTXSID30337250;ZINC161063;2-bromo-3-nitro-5-acetylthiophene;2-Bromo-3-Nitro-5-Acetyl Thiophene

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

Molecular Weight：

250.07000

Exact Mass：

248.91000

DSSTox ID：

DTXSID30337250

HScode：

2934999090

Characteristics

PSA：

91.13000

XLogP3：

3.14460

Density：

1.805g/cm3

Melting Point：

103-103.5 °C

Boiling Point：

302.3ºC at 760 mmHg

Flash Point：

136.6ºC

Refractive Index：

1.624

Vapor Pressure：

0.000997mmHg at 25°C

Computed Properties

Molecular Weight:250.07
XLogP3:2.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:248.90953
Monoisotopic Mass:248.90953
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-BROMO-4-NITRO-2-THIENYL)ETHAN-1-ONE

Basic Attributes
Characteristics
Computed Properties

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