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2,4,5,7-Octanetetrone

2,4,5,7-Octanetetrone structure

CAS No:
1114-91-6
Formula:
C8H10O4
Chemical Name:
2,4,5,7-Octanetetrone
Synonyms:
2,4,5,7-Octanetetrone;Octane-2,4,5,7-tetraone

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2,4,5,7-Octanetetrone Basic Attributes

Molecular Weight：

170.164

Exact Mass：

170.16

EC Number：

214-218-0

DSSTox ID：

DTXSID60149646

HScode：

2914190090

Characteristics

PSA：

68.3

XLogP3：

-0.7

Density：

1.141±0.06 g/cm3(Predicted)

Melting Point：

120 °C

Boiling Point：

252.3±25.0 °C(Predicted)

Computed Properties

Molecular Weight:170.16
XLogP3:-0.7
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:170.05790880
Monoisotopic Mass:170.05790880
Topological Polar Surface Area:68.3
Heavy Atom Count:12
Complexity:213
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,4,5,7-Octanetetrone

Basic Attributes
Characteristics
Computed Properties

2,4,5,7-Octanetetrone

SDS

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