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Structure

2-Bromo-4-(trifluoromethyl)phenol

CAS
81107-97-3
Catalog Number
ACM81107973
Category
Bromine Series
Molecular Weight
241.01
Molecular Formula
C7H4BrF3O

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Specification

Synonyms
2-Bromo-4-(trifluoromethyl)phenol, 81107-97-3, 2-Bromo-4-Trifluoromethylphenol, ST51042189, ZINC04290331, PubChem18455, ACMC-209pkp, AC1MC4C2, SureCN1290586, KSC495C0J, CTK3J5104, MolPort-000-159-773, ANW-37415, SBB099359, AKOS005259238, AG-H-25929, AG-L-24522, AM61667, LS10073, Phenol, 2-bromo-4-(trifluoromethyl)-
IUPAC Name
2-bromo-4-(trifluoromethyl)phenol
Canonical SMILES
C1=CC(=C(C=C1C(F)(F)F)Br)O
InChI Key
DTEDKIRYMYDIGO-UHFFFAOYSA-N
Boiling Point
196.7ºC at 760 mmHg
Flash Point
72.8ºC
Density
1.752g/cm³
Exact Mass
239.94000
H-Bond Acceptor
4
H-Bond Donor
1
What is the molecular formula of 2-Bromo-4-(trifluoromethyl)phenol?

The molecular formula of 2-Bromo-4-(trifluoromethyl)phenol is C7H4BrF3O.

What is the molecular weight of 2-Bromo-4-(trifluoromethyl)phenol?

The molecular weight of 2-Bromo-4-(trifluoromethyl)phenol is 241.00 g/mol.

What is the IUPAC name of 2-Bromo-4-(trifluoromethyl)phenol?

The IUPAC name of 2-Bromo-4-(trifluoromethyl)phenol is 2-bromo-4-(trifluoromethyl)phenol.

What is the InChI of 2-Bromo-4-(trifluoromethyl)phenol?

The InChI of 2-Bromo-4-(trifluoromethyl)phenol is InChI=1S/C7H4BrF3O/c8-5-3-4(7(9,10)11)1-2-6(5)12/h1-3,12H.

What is the InChIKey of 2-Bromo-4-(trifluoromethyl)phenol?

The InChIKey of 2-Bromo-4-(trifluoromethyl)phenol is DTEDKIRYMYDIGO-UHFFFAOYSA-N.

What is the canonical SMILES of 2-Bromo-4-(trifluoromethyl)phenol?

The canonical SMILES of 2-Bromo-4-(trifluoromethyl)phenol is C1=CC(=C(C=C1C(F)(F)F)Br)O.

What is the CAS number of 2-Bromo-4-(trifluoromethyl)phenol?

The CAS number of 2-Bromo-4-(trifluoromethyl)phenol is 81107-97-3.

What is the EC number of 2-Bromo-4-(trifluoromethyl)phenol?

The EC number of 2-Bromo-4-(trifluoromethyl)phenol is 635-509-2.

What is the XLogP3 value of 2-Bromo-4-(trifluoromethyl)phenol?

The XLogP3 value of 2-Bromo-4-(trifluoromethyl)phenol is 2.7.

Is 2-Bromo-4-(trifluoromethyl)phenol a canonicalized compound?

Yes, 2-Bromo-4-(trifluoromethyl)phenol is a canonicalized compound.

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