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5-(5,5-dimethyl-1,3-dioxan-2-yl)-1-(3-iodo-4-methylphenyl)pentan-1-one

5-(5,5-dimethyl-1,3-dioxan-2-yl)-1-(3-iodo-4-methylphenyl)pentan-1-one structure

CAS No:
898757-17-0
Formula:
C18H25IO3
Chemical Name:
5-(5,5-dimethyl-1,3-dioxan-2-yl)-1-(3-iodo-4-methylphenyl)pentan-1-one
Synonyms:
5-(5,5-DIMETHYL-1,3-DIOXAN-2-YL)-3'-IODO-4'-METHYLVALEROPHENONE;

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5-(5,5-dimethyl-1,3-dioxan-2-yl)-1-(3-iodo-4-methylphenyl)pentan-1-one Basic Attributes

Molecular Weight：

416.29400

Exact Mass：

416.08484

DSSTox ID：

DTXSID60646069

HScode：

2932999099

Characteristics

PSA：

35.53000

XLogP3：

4.74180

Density：

1.335g/cm3

Boiling Point：

464.6ºC at 760 mmHg

Flash Point：

234.8ºC

Refractive Index：

1.533

Computed Properties

Molecular Weight:416.3
XLogP3:4.5
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:416.08484
Monoisotopic Mass:416.08484
Topological Polar Surface Area:35.5
Heavy Atom Count:22
Complexity:359
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-(5,5-dimethyl-1,3-dioxan-2-yl)-1-(3-iodo-4-methylphenyl)pentan-1-one

Basic Attributes
Characteristics
Computed Properties

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