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Home > Boronic Acids > 1198615-84-7
1198615-84-7 | Ethyl 3-(2-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)phenyl)propanoate
CAS No: 1198615-84-7 Catalog No: AG00947Q MDL No:MFCD18383989
Product Description
Catalog Number:
AG00947Q
Chemical Name:
Ethyl 3-(2-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)phenyl)propanoate
CAS Number:
1198615-84-7
Molecular Formula:
C17H25BO4
Molecular Weight:
304.1890
MDL Number:
MFCD18383989
IUPAC Name:
ethyl 3-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propanoate
InChI:
InChI=1S/C17H25BO4/c1-6-20-15(19)12-11-13-9-7-8-10-14(13)18-21-16(2,3)17(4,5)22-18/h7-10H,6,11-12H2,1-5H3
InChI Key:
UFNHTIVEXCXWJJ-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCc1ccccc1B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
378
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.185g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
304.193g/mol
Monoisotopic Mass:
304.185g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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