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Home > Boronic Acids > 1196396-03-8
1196396-03-8 | 2-(4-(2,6-difluorophenoxy)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS No: 1196396-03-8 Catalog No: AG00HF2J MDL No:MFCD18384050
Product Description
Catalog Number:
AG00HF2J
Chemical Name:
2-(4-(2,6-difluorophenoxy)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS Number:
1196396-03-8
Molecular Formula:
C18H19BF2O3
Molecular Weight:
332.1495
MDL Number:
MFCD18384050
IUPAC Name:
2-[4-(2,6-difluorophenoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C18H19BF2O3/c1-17(2)18(3,4)24-19(23-17)12-8-10-13(11-9-12)22-16-14(20)6-5-7-15(16)21/h5-11H,1-4H3
InChI Key:
NCTTYXHQBOVUNY-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccc(cc1)Oc1c(F)cccc1F
Properties
Complexity:
412
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.14g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
332.154g/mol
Monoisotopic Mass:
332.14g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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