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Home > Boronic Acids > 1201937-19-0
1201937-19-0 | 2-(4-Bromo-2-[1,3]dioxolan-2-yl-phenyl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane
CAS No: 1201937-19-0 Catalog No: AG00HFAI MDL No:
Product Description
Catalog Number:
AG00HFAI
Chemical Name:
2-(4-Bromo-2-[1,3]dioxolan-2-yl-phenyl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane
CAS Number:
1201937-19-0
Molecular Formula:
C16H20BNO4
Molecular Weight:
301.1453
IUPAC Name:
2-[4-bromo-2-(1,3-dioxolan-2-yl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C15H20BBrO4/c1-14(2)15(3,4)21-16(20-14)12-6-5-10(17)9-11(12)13-18-7-8-19-13/h5-6,9,13H,7-8H2,1-4H3
InChI Key:
NDOMMNNJXIDROQ-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(c(c1)C1OCCO1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
368
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
354.064g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
355.035g/mol
Monoisotopic Mass:
354.064g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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