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Home > Boronic Acids > 119441-89-3
119441-89-3 | Boronic acid, B-[(1E)-2-bromoethenyl]-, bis(1-methylethyl) ester
CAS No: 119441-89-3 Catalog No: AG000ISC MDL No:
Product Description
Catalog Number:
AG000ISC
Chemical Name:
Boronic acid, B-[(1E)-2-bromoethenyl]-, bis(1-methylethyl) ester
CAS Number:
119441-89-3
Molecular Formula:
C8H16BBrO2
Molecular Weight:
234.9264
IUPAC Name:
2-bromoethenyl-di(propan-2-yloxy)borane
InChI:
InChI=1S/C8H16BBrO2/c1-7(2)11-9(5-6-10)12-8(3)4/h5-8H,1-4H3
InChI Key:
OCOSAJWMDGEJAM-UHFFFAOYSA-N
SMILES:
Br/C=C/B(OC(C)C)OC(C)C
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.043g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.928g/mol
Monoisotopic Mass:
234.043g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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