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1-[5-(1,3-Dioxolan-2-yl)-2-thienyl]-1-butanone

1-[5-(1,3-Dioxolan-2-yl)-2-thienyl]-1-butanone structure

CAS No:
898771-84-1
Formula:
C11H14O3S
Chemical Name:
1-[5-(1,3-Dioxolan-2-yl)-2-thienyl]-1-butanone
Synonyms:
1-Butanone,1-[5-(1,3-dioxolan-2-yl)-2-thienyl]-;1-[5-(1,3-Dioxolan-2-yl)-2-thienyl]-1-butanone

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1-[5-(1,3-Dioxolan-2-yl)-2-thienyl]-1-butanone Basic Attributes

Molecular Weight：

226.29200

Exact Mass：

226.29

DSSTox ID：

DTXSID20641873

HScode：

2934999090

Characteristics

PSA：

63.77000

XLogP3：

2.77630

Density：

1.197g/cm3

Boiling Point：

371.1ºC at 760 mmHg

Flash Point：

178.2ºC

Refractive Index：

1.538

Computed Properties

Molecular Weight:226.29
XLogP3:1.9
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:226.06636548
Monoisotopic Mass:226.06636548
Topological Polar Surface Area:63.8
Heavy Atom Count:15
Complexity:226
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[5-(1,3-Dioxolan-2-yl)-2-thienyl]-1-butanone

Basic Attributes
Characteristics
Computed Properties

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