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5,5-Dimethyl-2-butanal-1,3-dioxane

5,5-Dimethyl-2-butanal-1,3-dioxane structure

CAS No:
127600-13-9
Formula:
C10H18O3
Chemical Name:
5,5-Dimethyl-2-butanal-1,3-dioxane
Synonyms:
5,5-DIMETHYL-2-(3'-FORMYLPROPYL)-1,3-DIOXANE; 4-(5,5-dimethyl-1,3-dioxan-2-yl)butanal; 5,5-Dimethyl-1,3-dioxane-2-butanal;

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5,5-Dimethyl-2-butanal-1,3-dioxane Basic Attributes

Molecular Weight：

186.24800

Exact Mass：

186.125594432

DSSTox ID：

DTXSID60370493

HScode：

2932999099

Characteristics

PSA：

35.53000

XLogP3：

1.75470

Density：

0.955g/cm3

Boiling Point：

257.4ºC at 760mmHg

Flash Point：

100.1ºC

Refractive Index：

1.4475-1.4495

Vapor Pressure：

0.0145mmHg at 25°C

Safety Information

hazard class code：

R36/37/38

safety instructions：

S37/39

Marks：

Computed Properties

Molecular Weight:186.25
XLogP3:1.2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:186.125594432
Monoisotopic Mass:186.125594432
Topological Polar Surface Area:35.5
Heavy Atom Count:13
Complexity:156
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5,5-Dimethyl-2-butanal-1,3-dioxane

Basic Attributes
Characteristics
Safety Information
Computed Properties

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