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Ethyl 2,3,4,5,6-pentafluorobenzoate

Ethyl 2,3,4,5,6-pentafluorobenzoate structure

CAS No:
4522-93-4
Formula:
C9H5F5O2
Chemical Name:
Ethyl 2,3,4,5,6-pentafluorobenzoate
Synonyms:
Benzoic acid,2,3,4,5,6-pentafluoro-,ethyl ester;Benzoic acid,pentafluoro-,ethyl ester;Ethyl 2,3,4,5,6-pentafluorobenzoate;Ethyl pentafluorobenzoate;(Ethoxycarbonyl)pentafluorobenzene;Pentafluorobenzoic acid ethyl ester
Categories:
Organic Chemistry > Organic Fluorine Compound

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Ethyl 2,3,4,5,6-pentafluorobenzoate Basic Attributes

Molecular Weight：

240.13

Exact Mass：

240.13

BRN：

2054770

EC Number：

224-854-0

DSSTox ID：

DTXSID20196439

HScode：

2916399090

Characteristics

PSA：

26.3

XLogP3：

2.55880

Density：

1.431 g/mL at 25 °C(lit.)

Boiling Point：

63 °C @ Press: 5 Torr

Flash Point：

177 °F

Refractive Index：

n20/D 1.428(lit.)

Safety Information

Hazard category：

FLAMMABLE

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36-37-23

Marks：

Xi,F

Hazard note：

Flammable

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 45 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:240.13
XLogP3:2.6
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:240.02097021
Monoisotopic Mass:240.02097021
Topological Polar Surface Area:26.3
Heavy Atom Count:16
Complexity:246
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 4522-93-4

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Guide of Ethyl 2,3,4,5,6-pentafluorobenzoate

Basic Attributes
Characteristics
Safety Information
Computed Properties
Recommended Suppliers
Latest News
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Ethyl 2,3,4,5,6-pentafluorobenzoate

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