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4-(5,7-dioxo-2,3-dihydro-[1,4]dithiino[2,3-c]pyrrol-6-yl)benzaldehyde

4-(5,7-dioxo-2,3-dihydro-[1,4]dithiino[2,3-c]pyrrol-6-yl)benzaldehyde structure

CAS No:
54627-05-3
Formula:
C13H9NO3S2
Chemical Name:
4-(5,7-dioxo-2,3-dihydro-[1,4]dithiino[2,3-c]pyrrol-6-yl)benzaldehyde
Synonyms:
Benzaldehyde, 4-(2,3,5,7-tetrahydro-5,7-dioxo-6H-1,4-dithiino(2,3-c)pyrrol-6-yl)-;54627-05-3;RA(sub 15);4-(2,3,5,7-Tetrahydro-5,7-dioxo-6H-1,4-dithiino(2,3-c)pyrrol-6-yl)benzaldehyde;DTXSID80203057;4-(5,7-dioxo-2,3-dihydro-[1,4]dithiino[2,3-c]pyrrol-6-yl)benzaldehyde

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4-(5,7-dioxo-2,3-dihydro-[1,4]dithiino[2,3-c]pyrrol-6-yl)benzaldehyde Basic Attributes

Molecular Weight：

291.3 g/mol

Exact Mass：

291.00238550 g/mol

DSSTox ID：

DTXSID80203057

Characteristics

PSA：

105 Å²

Computed Properties

Molecular Weight:291.3
XLogP3:1.7
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:291.00238550
Monoisotopic Mass:291.00238550
Topological Polar Surface Area:105
Heavy Atom Count:19
Complexity:439
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(5,7-dioxo-2,3-dihydro-[1,4]dithiino[2,3-c]pyrrol-6-yl)benzaldehyde

Basic Attributes
Characteristics
Computed Properties

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