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Benzoic acid, 3-(trifluoromethyl)-, ethyl ester

Benzoic acid, 3-(trifluoromethyl)-, ethyl ester structure

CAS No:
76783-59-0
Formula:
C10H9F3O2
Chemical Name:
Benzoic acid, 3-(trifluoromethyl)-, ethyl ester
Synonyms:
Benzoic acid,3-(trifluoromethyl)-,ethyl ester;Ethyl 3-(trifluoromethyl)benzoate;Ethyl m-(trifluoromethyl)benzoate;3-(Trifluoromethyl)benzoic acid ethyl ester

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Benzoic acid, 3-(trifluoromethyl)-, ethyl ester Basic Attributes

Molecular Weight：

218.17

Exact Mass：

218.17

BRN：

1968226

EC Number：

-0

DSSTox ID：

DTXSID40227592

HScode：

2916399090

Characteristics

PSA：

26.3

XLogP3：

3.6

Appearance：

clear, colorless liquid

Density：

1.2±0.1 g/cm3

Boiling Point：

28-29 °C @ Press: 0.19 Torr

Flash Point：

100-101°C/10mm

Refractive Index：

1.450

Safety Information

Hazard category：

FLAMMABLE

Transport codes：

UN1993

hazard class code：

36/37/38

safety instructions：

26-37

Marks：

Xi,F

Hazard note：

Irritant

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

Benzoic acid, 3-(trifluoromethyl)-, ethyl ester Use and Manufacturing

Manufacturing Info：

Benzoic acid, 3-(trifluoromethyl)-, ethyl ester: ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Computed Properties

Molecular Weight:218.17
XLogP3:3.6
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:218.05546401
Monoisotopic Mass:218.05546401
Topological Polar Surface Area:26.3
Heavy Atom Count:15
Complexity:225
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Benzoic acid, 3-(trifluoromethyl)-, ethyl ester

Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Learn More Other Chemicals

Benzoic acid, 3-(trifluoromethyl)-, ethyl ester

SDS

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