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1-(1-benzothiophen-2-yl)-4,4,4-trifluorobutane-1,3-dione

1-(1-benzothiophen-2-yl)-4,4,4-trifluorobutane-1,3-dione structure

CAS No:
399-80-4
Formula:
C12H7F3O2S
Chemical Name:
1-(1-benzothiophen-2-yl)-4,4,4-trifluorobutane-1,3-dione
Synonyms:
1-benzo[1,3]dioxol-5-yl-pentan-1-ol; 1-(1,3-benzodioxol-5-yl)-1-pentanol; 1-Benzo[b]thiophen-2-yl-4,4,4-trifluor-butan-1,3-dion; 1-(3,4-methylenedioxyphenyl)-pentan-1-ol; 1-(3,4-methylenedioxyphenyl)pentanol; 1-benzo[b]thiophen-2-yl-4,4,4-trifluoro-butane-1,3-dione; 1-(3,4-methylenedioxyphenyl)-n-pentanol;Expand

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1-(1-benzothiophen-2-yl)-4,4,4-trifluorobutane-1,3-dione Basic Attributes

Molecular Weight：

272.24300

Exact Mass：

272.01188512 g/mol

NSC Number：

80430

Characteristics

PSA：

62.38000

XLogP3：

3.60550

Density：

1.424g/cm3

Boiling Point：

351ºC

Flash Point：

166.1ºC

Refractive Index：

1.565

Computed Properties

Molecular Weight:272.24
XLogP3:3.9
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:272.01188512
Monoisotopic Mass:272.01188512
Topological Polar Surface Area:62.4
Heavy Atom Count:18
Complexity:354
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(1-benzothiophen-2-yl)-4,4,4-trifluorobutane-1,3-dione

Basic Attributes
Characteristics
Computed Properties

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