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Home > Boronic Acids > 1154741-05-5
1154741-05-5 | 2H-1-Benzopyran, 8-fluoro-3,4-dihydro-5-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS No: 1154741-05-5 Catalog No: AG000G0R MDL No:
Product Description
Catalog Number:
AG000G0R
Chemical Name:
2H-1-Benzopyran, 8-fluoro-3,4-dihydro-5-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS Number:
1154741-05-5
Molecular Formula:
C16H22BFO3
Molecular Weight:
292.1535
IUPAC Name:
2-(8-fluoro-5-methyl-3,4-dihydro-2H-chromen-6-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C16H22BFO3/c1-10-11-7-6-8-19-14(11)13(18)9-12(10)17-20-15(2,3)16(4,5)21-17/h9H,6-8H2,1-5H3
InChI Key:
KAZNLRZPFCESHH-UHFFFAOYSA-N
SMILES:
Cc1c(cc(c2c1CCCO2)F)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
385
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.165g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
292.157g/mol
Monoisotopic Mass:
292.165g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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