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METHYL3,4,5-TRIFLUOROBENZENECARBOXYLATE

METHYL3,4,5-TRIFLUOROBENZENECARBOXYLATE structure

CAS No:
773873-72-6
Formula:
C8H5F3O2
Chemical Name:
METHYL3,4,5-TRIFLUOROBENZENECARBOXYLATE
Synonyms:
RARECHEM AL BF 0343;METHYL 3,4,5-TRIFLUOROBENZENECARBOXYLATE;Methyl 3,4,5-trifluorobenzoate;5-trifluorobenzoate;Methyl 3;3,4,5-trifluoroMethyl benzoate;3,4,5-Trifluorobenzoic acid methyl ester;Methyl3,4,5-trifluorobenzoate99%

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METHYL3,4,5-TRIFLUOROBENZENECARBOXYLATE Basic Attributes

Molecular Weight：

190.12

Exact Mass：

190.02416388

DSSTox ID：

DTXSID00382510

Characteristics

Density：

1.358±0.06 g/cm3

Boiling Point：

211.1±40.0 °C(Predicted)

Safety Information

Hazard category：

IRRITANT

Marks：

GHS Classification：

|Warning|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, 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 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:190.12
XLogP3:2.1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:190.02416388
Monoisotopic Mass:190.02416388
Topological Polar Surface Area:26.3
Heavy Atom Count:13
Complexity:186
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of METHYL3,4,5-TRIFLUOROBENZENECARBOXYLATE

Basic Attributes
Characteristics
Safety Information
Computed Properties

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