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1-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-3,3-dimethylbutan-1-one

1-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-3,3-dimethylbutan-1-one structure

CAS No:
898772-86-6
Formula:
C13H18O3S
Chemical Name:
1-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-3,3-dimethylbutan-1-one

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1-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-3,3-dimethylbutan-1-one Basic Attributes

Molecular Weight：

254.34500

Exact Mass：

254.09766561

DSSTox ID：

DTXSID80641910

HScode：

2934999090

Characteristics

PSA：

63.77000

XLogP3：

3.41240

Density：

1.145g/cm3

Boiling Point：

382ºC

Flash Point：

184.8ºC

Refractive Index：

1.528

Computed Properties

Molecular Weight:254.35
XLogP3:2.7
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:254.09766561
Monoisotopic Mass:254.09766561
Topological Polar Surface Area:63.8
Heavy Atom Count:17
Complexity:279
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-3,3-dimethylbutan-1-one

Basic Attributes
Characteristics
Computed Properties

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