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3-[(4-CHLOROPHENYL)THIO]PENTANE-2,4-DIONE

3-[(4-CHLOROPHENYL)THIO]PENTANE-2,4-DIONE structure

CAS No:
132787-93-0
Formula:
C11H11ClO2S
Chemical Name:
3-[(4-CHLOROPHENYL)THIO]PENTANE-2,4-DIONE
Synonyms:
3-[(4-CHLOROPHENYL)THIO]PENTANE-2,4-DIONE;3-(4-Chloro-phenylsulfanyl)-pentane-2,4-dione

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3-[(4-CHLOROPHENYL)THIO]PENTANE-2,4-DIONE Basic Attributes

Molecular Weight：

242.72

Exact Mass：

242.01700

DSSTox ID：

DTXSID90352303

Characteristics

PSA：

59.4

XLogP3：

2.97870

Density：

1.26±0.1 g/cm3(Predicted)

Melting Point：

69 °C

Boiling Point：

330.0±42.0 °C(Predicted)

Flash Point：

153.4ºC

Refractive Index：

1.568

Vapor Pressure：

0.000171mmHg at 25°C

Safety Information

Marks：

Hazard note：

Irritant

Computed Properties

Molecular Weight:242.72
XLogP3:2.8
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:242.0168285
Monoisotopic Mass:242.0168285
Topological Polar Surface Area:59.4
Heavy Atom Count:15
Complexity:233
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-[(4-CHLOROPHENYL)THIO]PENTANE-2,4-DIONE

Basic Attributes
Characteristics
Safety Information
Computed Properties

3-[(4-CHLOROPHENYL)THIO]PENTANE-2,4-DIONE

SDS

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