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Home > Boronic Acids > 1448894-65-2
1448894-65-2 | 2-(benzyloxy)-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
CAS No: 1448894-65-2 Catalog No: AG00HX8Q MDL No:MFCD24039734
Product Description
Catalog Number:
AG00HX8Q
Chemical Name:
2-(benzyloxy)-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
CAS Number:
1448894-65-2
Molecular Formula:
C20H22BNO3
Molecular Weight:
335.2046
MDL Number:
MFCD24039734
IUPAC Name:
2-phenylmethoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
InChI:
InChI=1S/C20H22BNO3/c1-19(2)20(3,4)25-21(24-19)17-11-10-16(13-22)18(12-17)23-14-15-8-6-5-7-9-15/h5-12H,14H2,1-4H3
InChI Key:
YDEUNLVOYPZMFK-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1OCc1ccccc1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
490
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.169g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
335.21g/mol
Monoisotopic Mass:
335.169g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
51.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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