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2-Acetoacetylpyridine

2-Acetoacetylpyridine structure

CAS No:
40614-52-6
Formula:
C9H9NO2
Chemical Name:
2-Acetoacetylpyridine
Synonyms:
1-(pyridin-2-yl)butane-1,3-dione;1-(2-Pyridinyl)-1,3-butanedione;1,3-Butanedione, 1-(2-pyridinyl)-;1-pyridin-2-ylbutane-1,3-dione;1-pyridin-2-yl-butane-1,3-dione;2-Acetoacetylpyridine;1-(2-PYRIDYL)-1,3-BUTANEDIONE;2-Acetoacetylpyridin;SCHEMBL1360847;CTK1D4428

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2-Acetoacetylpyridine Basic Attributes

Molecular Weight：

163.176

Exact Mass：

163.063

DSSTox ID：

DTXSID30507537

Characteristics

PSA：

XLogP3：

0.7

Density：

1.2021 (rough estimate)

Melting Point：

50°C

Computed Properties

Molecular Weight:163.17
XLogP3:0.7
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:163.063328530
Monoisotopic Mass:163.063328530
Topological Polar Surface Area:47
Heavy Atom Count:12
Complexity:189
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Acetoacetylpyridine

Basic Attributes
Characteristics
Computed Properties

2-Acetoacetylpyridine

SDS

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