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2-Pyridinecarboxylicacid,5-(trifluoromethyl)-,ethylester

2-Pyridinecarboxylicacid,5-(trifluoromethyl)-,ethylester structure

CAS No:
128072-94-6
Formula:
C9H8F3NO2
Chemical Name:
2-Pyridinecarboxylicacid,5-(trifluoromethyl)-,ethylester
Synonyms:
2-Pyridinecarboxylicacid,5-(trifluoromethyl)-,ethylester;5-(Trifluoromethyl)-2-pyridinecarboxylic acid ethyl ester;Ethyl 5-(trifluoromethyl)picolinate, 2-(Ethoxycarbonyl)-5-(trifluoromethyl)pyridine;Ethyl 5-(trifluoromethyl)-pyridine-2-carboxylate >=95.0%;Ethyl 5-(trifluoromethyl)
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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2-Pyridinecarboxylicacid,5-(trifluoromethyl)-,ethylester Basic Attributes

Molecular Weight：

219.16

Exact Mass：

219.050720

DSSTox ID：

DTXSID20650743

HScode：

2933399090

Characteristics

PSA：

39.2

XLogP3：

1.8

Density：

1.3±0.1 g/cm3

Melting Point：

45-48°

Boiling Point：

264.7°C at 760 mmHg

Flash Point：

113.9±27.3 °C

Refractive Index：

1.449

Vapor Pressure：

0.00955mmHg at 25°C

Safety Information

Hazard category：

IRRITANT

Transport codes：

UN 2811 6.1 / PGIII

hazard class code：

22-36/37/38

safety instructions：

Marks：

Precautionary statement(s)：

P261-P301 + P310-P305 + P351 + P338

Hazard Statements：

H301-H315-H319-H335

GHS Classification：

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:219.16
XLogP3:1.8
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:219.05071298
Monoisotopic Mass:219.05071298
Topological Polar Surface Area:39.2
Heavy Atom Count:15
Complexity:230
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Pyridinecarboxylicacid,5-(trifluoromethyl)-,ethylester

Basic Attributes
Characteristics
Safety Information
Computed Properties
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2-Pyridinecarboxylicacid,5-(trifluoromethyl)-,ethylester

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