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Home > Encyclopedia > methyl 5-(trifluoromethyl)-1-benzothiophene-2-carboxylate

methyl 5-(trifluoromethyl)-1-benzothiophene-2-carboxylate

methyl 5-(trifluoromethyl)-1-benzothiophene-2-carboxylate structure

methyl 5-(trifluoromethyl)-1-benzothiophene-2-carboxylate 

structure
  • CAS No:

    146137-92-0

  • Formula:

    C11H7F3O2S

  • Chemical Name:

    methyl 5-(trifluoromethyl)-1-benzothiophene-2-carboxylate

  • Synonyms:

    methyl 5-(trifluoromethyl)benzo[b]thiophene-2-carboxylate; Benzo[b]thiophene-2-carboxylicacid,5-(trifluoromethyl)-,methyl ester;

  • Categories:

    Chemical Reagents  >  Organic Reagents

methyl 5-(trifluoromethyl)-1-benzothiophene-2-carboxylate Basic Attributes

260.23200

260.01188512

DTXSID10363133

2934999090

Characteristics

54.54000

3.70670

1.41g/cm3

123-124ºC

312.4ºC

142.7ºC

1.555

0.00053mmHg at 25°C

Safety Information

Xi

|Warning|H302+H312+H332 (100%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]|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:260.23
XLogP3:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:260.01188512
Monoisotopic Mass:260.01188512
Topological Polar Surface Area:54.5
Heavy Atom Count:17
Complexity:306
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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