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Home > Boronic Acids > 1218790-36-3
1218790-36-3 | 1,3,2-Dioxaborolane, 2-(3-bromo-5-propoxyphenyl)-4,4,5,5-tetramethyl-
CAS No: 1218790-36-3 Catalog No: AG00168R MDL No:MFCD12546585
Product Description
Catalog Number:
AG00168R
Chemical Name:
1,3,2-Dioxaborolane, 2-(3-bromo-5-propoxyphenyl)-4,4,5,5-tetramethyl-
CAS Number:
1218790-36-3
Molecular Formula:
C15H22BBrO3
Molecular Weight:
341.0484
MDL Number:
MFCD12546585
IUPAC Name:
2-(3-bromo-5-propoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C15H22BBrO3/c1-6-7-18-13-9-11(8-12(17)10-13)16-19-14(2,3)15(4,5)20-16/h8-10H,6-7H2,1-5H3
InChI Key:
LRPWJRKNTVJVHO-UHFFFAOYSA-N
SMILES:
CCCOc1cc(Br)cc(c1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
340.085g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
341.052g/mol
Monoisotopic Mass:
340.085g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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