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2-Pentafluorophenyl-malonicaciddiethylester

2-Pentafluorophenyl-malonicaciddiethylester structure

CAS No:
1582-05-4
Formula:
C13H11F5O4
Chemical Name:
2-Pentafluorophenyl-malonicaciddiethylester
Synonyms:
Diethyl pentafluorophenyl-malonate;Diethyl 2-(perfluorophenyl)malonate;2-Pentafluorophenyl-malonic acid diethyl ester;EC-000.1817;Diethyl 2-(2,3,4,5,6-pentafluorophenyl)propanedioate;SCHEMBL7490532;DTXSID80456364;ZINC22114967;diethyl 2-(2,3,4,5,6-pentafluorophenyl)malonate

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2-Pentafluorophenyl-malonicaciddiethylester Basic Attributes

Molecular Weight：

326.21600

Exact Mass：

326.05800

DSSTox ID：

DTXSID80456364

HScode：

2917399090

Characteristics

PSA：

52.60000

XLogP3：

2.59190

Density：

1.397g/cm3

Boiling Point：

282.132ºC at 760 mmHg

Flash Point：

120.598ºC

Refractive Index：

1.448

Computed Properties

Molecular Weight:326.22
XLogP3:3.1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:7
Exact Mass:326.05774964
Monoisotopic Mass:326.05774964
Topological Polar Surface Area:52.6
Heavy Atom Count:22
Complexity:374
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Pentafluorophenyl-malonicaciddiethylester

Basic Attributes
Characteristics
Computed Properties

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