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1-(4,6-dibromothieno[3,4-b]thiophen-2-yl)-2-ethylhexan-1-one

1-(4,6-dibromothieno[3,4-b]thiophen-2-yl)-2-ethylhexan-1-one structure

CAS No:
1194605-76-9
Formula:
C14H16Br2OS2
Chemical Name:
1-(4,6-dibromothieno[3,4-b]thiophen-2-yl)-2-ethylhexan-1-one
Synonyms:
1-(4,6-Dibromothieno[3,4-b]thiophen-2-yl)-2-ethylhexan-1-one;C14H16Br2OS2;SCHEMBL321192;DTXSID90728827;3336AA;DA-14695;FT-0749950;2-(2-Ethylhexanoyl)-4,6-dibromothieno[3,4-b]thiophene;1-(4,6-dibromothieno[2,3-c]thiophen-2-yl)-2-ethylhexan-1-one;1-(4,6-Dibromothieno[3,2-c ]thiophen-2-yl)-2-ethylhexan-1-one

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1-(4,6-dibromothieno[3,4-b]thiophen-2-yl)-2-ethylhexan-1-one Basic Attributes

Molecular Weight：

424.21424

Exact Mass：

421.90100

DSSTox ID：

DTXSID90728827

HScode：

2934999090

Characteristics

PSA：

73.6

XLogP3：

6.88690

Density：

1.595±0.06 g/cm3(Predicted)

Boiling Point：

458.4±40.0 °C(Predicted)

Computed Properties

Molecular Weight:424.2
XLogP3:7.5
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:423.89888
Monoisotopic Mass:421.90093
Topological Polar Surface Area:73.6
Heavy Atom Count:19
Complexity:327
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(4,6-dibromothieno[3,4-b]thiophen-2-yl)-2-ethylhexan-1-one

Basic Attributes
Characteristics
Computed Properties

1-(4,6-dibromothieno[3,4-b]thiophen-2-yl)-2-ethylhexan-1-one

SDS

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