Related Searches: Boronicacid, B-[4-(trifluoromethyl)phenyl]-, Boronicacid, B-[2-(trifluoromethyl)phenyl]-, Boronicacid, B-[3-(trifluoromethyl)phenyl]-, Boronicacid, B-[4-(trifluoromethoxy)phenyl]-, Boronicacid, B-4-pyridinyl-, View all

Boronicacid, B-[4-(trifluoromethyl)phenyl]-(CAS No. 128796-39-4)

Boronicacid, B-[4-(trifluoromethyl)phenyl]- C7H6BF3O2 (cas 128796-39-4) Molecular Structure

128796-39-4 Structure

Identification and Related Records

【Name】
Boronicacid, B-[4-(trifluoromethyl)phenyl]-
【Iupac name】
[4-(trifluoromethyl)phenyl]boronic acid
【CAS Registry number】
128796-39-4
【Synonyms】
Boronicacid, [4-(trifluoromethyl)phenyl]- (9CI)
4-(Trifluoromethyl)benzeneboronicacid
4-(Trifluoromethyl)phenylboronic acid
[p-(Trifluoromethyl)phenyl]boronicacid
α,α,α-Trifluoro-p-tolylboronic acid
4-(trifluoromethyl)phchylboronic acid)
【Molecular Formula】
C7H6BF3O2 (Products with the same molecular formula)
【Molecular Weight】
189.93
【Inchi】
InChI=1/C7H6BF3O2/c9-7(10,11)5-1-3-6(4-2-5)8(12)13/h1-4,12-13H
【Canonical SMILES】
B(C1=CC=C(C=C1)C(F)(F)F)(O)O
【MOL File】
128796-39-4.mol

Chemical and Physical Properties

【Appearance】
white powder
【Density】
1.36g/cm3
【Melting Point】
245-250℃
【Boiling Point】
258.6°C at 760 mmHg
【Vapour】
0.00696mmHg at 25°C
【Refractive Index】
1.461
【Flash Point】
110.2°C
【Storage temp】
0-6°C
【Computed Properties】
Molecular Weight:189.92755 [g/mol]
Molecular Formula:C7H6BF3O2
H-Bond Donor:2
H-Bond Acceptor:5
Rotatable Bond Count:1
Exact Mass:190.041295
MonoIsotopic Mass:190.041295
Topological Polar Surface Area:40.5
Heavy Atom Count:13
Formal Charge:0
Complexity:164
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1

Safety and Handling

【Hazard Codes】
Xi:Irritant
【Risk Statements】
R36/37/38
【Safety Statements 】
S26;S37/39
【HazardClass】
IRRITANT
【Hazard Note】

Irritant

Supplier Location

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