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Home > Boronic Acids > 1325241-78-8
1325241-78-8 | 2-phenyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[d]oxazole
CAS No: 1325241-78-8 Catalog No: AG01DDKB MDL No:
Product Description
Catalog Number:
AG01DDKB
Chemical Name:
2-phenyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[d]oxazole
CAS Number:
1325241-78-8
Molecular Formula:
C19H20BNO3
Molecular Weight:
321.1780
IUPAC Name:
2-phenyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-benzoxazole
InChI:
InChI=1S/C19H20BNO3/c1-18(2)19(3,4)24-20(23-18)14-10-11-15-16(12-14)22-17(21-15)13-8-6-5-7-9-13/h5-12H,1-4H3
InChI Key:
FUBBIMKGJUIOCJ-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccc2c(c1)oc(n2)c1ccccc1
Properties
Complexity:
448
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.154g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
321.183g/mol
Monoisotopic Mass:
321.154g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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