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Home > Boronic Acids > 910462-34-9
910462-34-9 | 1-Methyl-4-{2-[4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenoxy]-ethyl}-piperazine
CAS No: 910462-34-9 Catalog No: AG00IGGH MDL No:MFCD09746225
Product Description
Catalog Number:
AG00IGGH
Chemical Name:
1-Methyl-4-{2-[4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenoxy]-ethyl}-piperazine
CAS Number:
910462-34-9
Molecular Formula:
C19H31BN2O3
Molecular Weight:
346.2720
MDL Number:
MFCD09746225
IUPAC Name:
1-methyl-4-[2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]ethyl]piperazine
InChI:
InChI=1S/C19H31BN2O3/c1-18(2)19(3,4)25-20(24-18)16-6-8-17(9-7-16)23-15-14-22-12-10-21(5)11-13-22/h6-9H,10-15H2,1-5H3
InChI Key:
WSCWCKAPDGWCOS-UHFFFAOYSA-N
SMILES:
CN1CCN(CC1)CCOc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
414
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
346.243g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
346.278g/mol
Monoisotopic Mass:
346.243g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
34.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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