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Ethyl(pentafluorobenzoyl)acetate

Ethyl(pentafluorobenzoyl)acetate structure

CAS No:
3516-87-8
Formula:
C11H7F5O3
Chemical Name:
Ethyl(pentafluorobenzoyl)acetate
Synonyms:
ETHYL(PENTAFLUOROBENZOYL)ACETATE;Ethyl(pentafluorobenzoyl)acetate98%;Ethyl(pentafluorobenzoyl)acetate98%;Ethyl3-oxo-3-(perfluorophenyl)propanoate;Ethyl3-oxo-3-(pentafluorophenyl)propanoate98%;3-OXO-3-PENTAFLUOROPHENYL-PROPIONICACIDETHYLESTER;ethylester2,3,4,5,6-pentafluoro-oxo-Benzenepropanoicacid;Ethyl(pentafluorobenzoyl)acetate,Ethyl3-oxo-3-(pentafluorophenyl)propionate
Categories:
Organic Chemistry > Coordination Complexes

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Ethyl(pentafluorobenzoyl)acetate Basic Attributes

Molecular Weight：

282.16

Exact Mass：

282.031525

EC Number：

1592732-453-0

DSSTox ID：

DTXSID90375077

Characteristics

PSA：

43.37000

XLogP3：

1.31

Density：

1.4±0.1 g/cm3

Boiling Point：

103-104 °C4 mm Hg(lit.)

Flash Point：

105 °F

Refractive Index：

1.445

Safety Information

Hazard category：

IRRITANT

Transport codes：

UN 3272 3/PG 3

wgk germany：

hazard class code：

20/21/22-36/37/38

safety instructions：

26-36

Marks：

Xn,Xi

Hazard note：

Irritant

Precautionary statement(s)：

P210, P233, P240, P241, P242, P243, P261, P264, P270, P271, P280, P301+P312, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P370+P378, P403+P233, P403+P235, P405, P501

Hazard Statements：

H226

GHS Classification：

|Warning|H226 (97.44%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P270, P271, P280, P301+P312, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P370+P378, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:282.16
XLogP3:2.5
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:282.03153489
Monoisotopic Mass:282.03153489
Topological Polar Surface Area:43.4
Heavy Atom Count:19
Complexity:335
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 3516-87-8

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Guide of Ethyl(pentafluorobenzoyl)acetate

Basic Attributes
Characteristics
Safety Information
Computed Properties
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Ethyl(pentafluorobenzoyl)acetate

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