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4-(5,5-Dimethyl-1,3-dioxan-2-yl)-1-(3-iodo-4-methylphenyl)-1-butanone

4-(5,5-Dimethyl-1,3-dioxan-2-yl)-1-(3-iodo-4-methylphenyl)-1-butanone structure

CAS No:
898757-15-8
Formula:
C17H23IO3
Chemical Name:
4-(5,5-Dimethyl-1,3-dioxan-2-yl)-1-(3-iodo-4-methylphenyl)-1-butanone
Synonyms:
1-Butanone,4-(5,5-dimethyl-1,3-dioxan-2-yl)-1-(3-iodo-4-methylphenyl)-;4-(5,5-Dimethyl-1,3-dioxan-2-yl)-1-(3-iodo-4-methylphenyl)-1-butanone

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4-(5,5-Dimethyl-1,3-dioxan-2-yl)-1-(3-iodo-4-methylphenyl)-1-butanone Basic Attributes

Molecular Weight：

402.26700

Exact Mass：

402.27

DSSTox ID：

DTXSID00646068

HScode：

2932999099

Characteristics

PSA：

35.53000

XLogP3：

4.35170

Density：

1.362g/cm3

Boiling Point：

452.6ºC

Flash Point：

227.5ºC

Refractive Index：

1.537

Computed Properties

Molecular Weight:402.27
XLogP3:4.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:402.06919
Monoisotopic Mass:402.06919
Topological Polar Surface Area:35.5
Heavy Atom Count:21
Complexity:346
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(5,5-Dimethyl-1,3-dioxan-2-yl)-1-(3-iodo-4-methylphenyl)-1-butanone

Basic Attributes
Characteristics
Computed Properties

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