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Home Aldehydes Benzaldehyde, 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)-

Benzaldehyde, 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)-

CAS No.:
1416721-24-8
Catalog Number:
AG001GUT
Molecular Formula:
C14H16BF3O3
Molecular Weight:
300.0812
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Product Description
Catalog Number:
AG001GUT
Chemical Name:
Benzaldehyde, 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)-
CAS Number:
1416721-24-8
Molecular Formula:
C14H16BF3O3
Molecular Weight:
300.0812
MDL Number:
MFCD18757662
IUPAC Name:
2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)benzaldehyde
InChI:
InChI=1S/C14H16BF3O3/c1-12(2)13(3,4)21-15(20-12)11-7-10(14(16,17)18)6-5-9(11)8-19/h5-8H,1-4H3
InChI Key:
SXGHUSPRZSUDTF-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1B1OC(C(O1)(C)C)(C)C)C(F)(F)F
Properties
Complexity:
393  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.114g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
300.084g/mol
Monoisotopic Mass:
300.114g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties