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Home > Boronic Acids > 850567-53-2
850567-53-2 | 2-(2-(2-Bromoethyl);phenyl);-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS No: 850567-53-2 Catalog No: AG008GTP MDL No:MFCD06659922
Product Description
Catalog Number:
AG008GTP
Chemical Name:
2-(2-(2-Bromoethyl);phenyl);-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS Number:
850567-53-2
Molecular Formula:
C14H20BBrO2
Molecular Weight:
311.0224
MDL Number:
MFCD06659922
IUPAC Name:
2-[2-(2-bromoethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C14H20BBrO2/c1-13(2)14(3,4)18-15(17-13)12-8-6-5-7-11(12)9-10-16/h5-8H,9-10H2,1-4H3
InChI Key:
MXPUVJQWJQJUND-UHFFFAOYSA-N
SMILES:
BrCCc1ccccc1B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.074g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
311.026g/mol
Monoisotopic Mass:
310.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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