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3-(1,3-Dithian-2-yl)pentane-2,4-dione

3-(1,3-Dithian-2-yl)pentane-2,4-dione structure

CAS No:
100596-16-5
Formula:
C9H14O2S2
Chemical Name:
3-(1,3-Dithian-2-yl)pentane-2,4-dione
Synonyms:
3-(1,3-dithian-2-yl)pentane-2,4-dione;

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3-(1,3-Dithian-2-yl)pentane-2,4-dione Basic Attributes

Molecular Weight：

218.33600

Exact Mass：

218.04352203

DSSTox ID：

DTXSID20455831

Characteristics

PSA：

84.74000

XLogP3：

1.97680

Density：

1.182g/cm3

Boiling Point：

352.694ºC

Flash Point：

154.316ºC

Refractive Index：

1.54

Vapor Pressure：

0mmHg at 25°C

Computed Properties

Molecular Weight:218.3
XLogP3:1.4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:218.04352203
Monoisotopic Mass:218.04352203
Topological Polar Surface Area:84.7
Heavy Atom Count:13
Complexity:196
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(1,3-Dithian-2-yl)pentane-2,4-dione

Basic Attributes
Characteristics
Computed Properties

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