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Ethyl 2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptanoate

Ethyl 2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptanoate structure

CAS No:
41430-70-0
Formula:
C9H5F13O2
Chemical Name:
Ethyl 2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptanoate
Synonyms:
Heptanoic acid,2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoro-,ethyl ester;Heptanoic acid,tridecafluoro-,ethyl ester;Ethyl 2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptanoate;Ethyl perfluoroheptanoate;Ethyl tridecafluoroheptanoate
Categories:
Organic Chemistry > Coordination Complexes

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Ethyl 2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptanoate Basic Attributes

Molecular Weight：

392.11400

Exact Mass：

392.11

EC Number：

255-362-4

DSSTox ID：

DTXSID80194350

HScode：

2915900090

Characteristics

PSA：

26.30000

XLogP3：

4.28830

Density：

1.557 g/cm3

Boiling Point：

87 °C @ Press: 20 Torr

Flash Point：

47.2ºC

Refractive Index：

1.302

Safety Information

hazard class code：

R36/37/38

safety instructions：

26-36

Marks：

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Ethyl 2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptanoate Use and Manufacturing

Use Classification：

PFAS (per- and polyfluoroalkyl substances) -> OECD Category

Computed Properties

Molecular Weight:392.11
XLogP3:4.8
Hydrogen Bond Acceptor Count:15
Rotatable Bond Count:7
Exact Mass:392.0081955
Monoisotopic Mass:392.0081955
Topological Polar Surface Area:26.3
Heavy Atom Count:24
Complexity:478
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Ethyl 2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptanoate

Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
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