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Home > Boronic Acids > 1073339-21-5

1073339-21-5

1073339-21-5 | 2-[2-(TRIFLUOROMETHYL)PHENYL]-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE

CAS No: 1073339-21-5 Catalog No: AG008WPF MDL No:MFCD06795676

Product Description

Catalog Number:
AG008WPF
Chemical Name:
2-[2-(TRIFLUOROMETHYL)PHENYL]-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE
CAS Number:
1073339-21-5
Molecular Formula:
C13H16BF3O2
Molecular Weight:
272.0711
MDL Number:
MFCD06795676
IUPAC Name:
4,4,5,5-tetramethyl-2-[2-(trifluoromethyl)phenyl]-1,3,2-dioxaborolane
InChI:
InChI=1S/C13H16BF3O2/c1-11(2)12(3,4)19-14(18-11)10-8-6-5-7-9(10)13(15,16)17/h5-8H,1-4H3
InChI Key:
HBQNDHPCMDZKNT-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccccc1C(F)(F)F

Properties

Complexity:
325  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.12g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.074g/mol
Monoisotopic Mass:
272.12g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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