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1-(2-Thienyl)-1,2-propanedione

1-(2-Thienyl)-1,2-propanedione structure

CAS No:
13678-69-8
Formula:
C7H6O2S
Chemical Name:
1-(2-Thienyl)-1,2-propanedione
Synonyms:
1,2-Propanedione,1-(2-thienyl)-;1-(2-Thienyl)-1,2-propanedione;(2-Thienyl)-1-propane-1,2-dione;1-(Thiophene-2-yl)propane-1,2-dione;1-(Thiophen-2-yl)propane-1,2-dione

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Description

1-(2-Thienyl)-1,2-propanedione is an aromatic ketone.

1-(2-Thienyl)-1,2-propanedione Basic Attributes

Molecular Weight：

154.19 g/mol

Exact Mass：

154.19

EC Number：

237-174-4

DSSTox ID：

DTXSID80159929

Characteristics

PSA：

62.4 Å²

XLogP3：

0.965 (est)

Melting Point：

46-47 °C

Boiling Point：

101-105 °C @ Press: 12 Torr

Water Solubility：

1.167e+004 mg/L @ 25 °C (est)

Computed Properties

Molecular Weight:154.19
XLogP3:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:154.00885060
Monoisotopic Mass:154.00885060
Topological Polar Surface Area:62.4
Heavy Atom Count:10
Complexity:165
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(2-Thienyl)-1,2-propanedione

Description
Basic Attributes
Characteristics
Computed Properties

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