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2-(1,3-benzothiazol-2-ylsulfanyl)-1-cyclopropylethanone

2-(1,3-benzothiazol-2-ylsulfanyl)-1-cyclopropylethanone structure

CAS No:
337488-10-5
Formula:
C12H11NOS2
Chemical Name:
2-(1,3-benzothiazol-2-ylsulfanyl)-1-cyclopropylethanone
Synonyms:
2-benzothiazol-2-ylthio-1-cyclopropylethan-1-one; 2,6-DIACETYLPYRIDINE;

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2-(1,3-benzothiazol-2-ylsulfanyl)-1-cyclopropylethanone Basic Attributes

Molecular Weight：

249.35200

Exact Mass：

249.02820632 g/mol

DSSTox ID：

DTXSID60354238

HScode：

2934200090

Characteristics

PSA：

83.50000

XLogP3：

3.36750

Density：

1.36g/cm3

Boiling Point：

399.2ºC

Flash Point：

195.2ºC

Refractive Index：

1.688

Computed Properties

Molecular Weight:249.4
XLogP3:3.3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:249.02820632
Monoisotopic Mass:249.02820632
Topological Polar Surface Area:83.5
Heavy Atom Count:16
Complexity:280
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(1,3-benzothiazol-2-ylsulfanyl)-1-cyclopropylethanone

Basic Attributes
Characteristics
Computed Properties

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