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Home > Boronic Acids > 161395-97-7
161395-97-7 | 2-Propen-1-ol, 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, 1-acetate, (2E)-
CAS No: 161395-97-7 Catalog No: AG001SEY MDL No:MFCD03788751
Product Description
Catalog Number:
AG001SEY
Chemical Name:
2-Propen-1-ol, 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, 1-acetate, (2E)-
CAS Number:
161395-97-7
Molecular Formula:
C11H19BO4
Molecular Weight:
226.0772
MDL Number:
MFCD03788751
IUPAC Name:
[(E)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enyl] acetate
InChI:
InChI=1S/C11H19BO4/c1-9(13)14-8-6-7-12-15-10(2,3)11(4,5)16-12/h6-7H,8H2,1-5H3/b7-6+
InChI Key:
ZXBRLGZFCXGTBA-VOTSOKGWSA-N
SMILES:
CC(=O)OC/C=C/B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
226.138g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.079g/mol
Monoisotopic Mass:
226.138g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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