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2-(Trifluoromethyl)-4-thiazolecarboxaldehyde

2-(Trifluoromethyl)-4-thiazolecarboxaldehyde structure

CAS No:
133046-48-7
Formula:
C5H2F3NOS
Chemical Name:
2-(Trifluoromethyl)-4-thiazolecarboxaldehyde
Synonyms:
4-Thiazolecarboxaldehyde,2-(trifluoromethyl)-;2-(Trifluoromethyl)-4-thiazolecarboxaldehyde;2-Trifluoromethyl-4-thiazolecarboxaldehyde;2-(Trifluoromethyl)-1,3-thiazole-4-carbaldehyde

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2-(Trifluoromethyl)-4-thiazolecarboxaldehyde Basic Attributes

Molecular Weight：

181.13600

Exact Mass：

181.14

DSSTox ID：

DTXSID90602274

Characteristics

PSA：

58.20000

XLogP3：

1.97440

Density：

1.544

Boiling Point：

155ºC

Flash Point：

47ºC

Refractive Index：

1.499

Vapor Pressure：

3.14mmHg at 25°C

Safety Information

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.

Computed Properties

Molecular Weight:181.14
XLogP3:1.7
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:180.98091935
Monoisotopic Mass:180.98091935
Topological Polar Surface Area:58.2
Heavy Atom Count:11
Complexity:160
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(Trifluoromethyl)-4-thiazolecarboxaldehyde

Basic Attributes
Characteristics
Safety Information
Computed Properties

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