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Home > Boronic Acids > 906352-77-0
906352-77-0 | 4-(2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)phenyl)morpholine
CAS No: 906352-77-0 Catalog No: AG003HQZ MDL No:MFCD09064984
Product Description
Catalog Number:
AG003HQZ
Chemical Name:
4-(2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)phenyl)morpholine
CAS Number:
906352-77-0
Molecular Formula:
C17H23BF3NO3
Molecular Weight:
357.1756
MDL Number:
MFCD09064984
IUPAC Name:
4-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)phenyl]morpholine
InChI:
InChI=1S/C17H23BF3NO3/c1-15(2)16(3,4)25-18(24-15)13-11-12(17(19,20)21)5-6-14(13)22-7-9-23-10-8-22/h5-6,11H,7-10H2,1-4H3
InChI Key:
FGPWVOFEKZVCDA-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1cc(ccc1N1CCOCC1)C(F)(F)F
Properties
Complexity:
464
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
357.172g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
357.18g/mol
Monoisotopic Mass:
357.172g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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