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Ethyl 3,4,5-trifluorobenzoate

Ethyl 3,4,5-trifluorobenzoate structure

CAS No:
495405-09-9
Formula:
C9H7F3O2
Chemical Name:
Ethyl 3,4,5-trifluorobenzoate
Synonyms:
Benzoic acid,3,4,5-trifluoro-,ethyl ester;Ethyl 3,4,5-trifluorobenzoate
Categories:
Organic Chemistry > Coordination Complexes

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Ethyl 3,4,5-trifluorobenzoate Basic Attributes

Molecular Weight：

204.1458896

Exact Mass：

204.15

HScode：

2916399090

Characteristics

PSA：

26.3

XLogP3：

2.4

Density：

1.304±0.06 g/cm3(Predicted)

Boiling Point：

229.9°C at 760 mmHg

Safety Information

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501

Hazard Statements：

H302

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, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Ethyl 3,4,5-trifluorobenzoate Use and Manufacturing

Manufacturing Info：

Benzoic acid, 3,4,5-trifluoro-, ethyl ester: ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Computed Properties

Molecular Weight:204.15
XLogP3:2.4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:204.03981395
Monoisotopic Mass:204.03981395
Topological Polar Surface Area:26.3
Heavy Atom Count:14
Complexity:198
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Ethyl 3,4,5-trifluorobenzoate

Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
Latest News
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Ethyl 3,4,5-trifluorobenzoate

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