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Home > Boronic Acids > 1643923-77-6
1643923-77-6 | Piperazine, 1-methyl-4-[1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclopropyl]-
CAS No: 1643923-77-6 Catalog No: AG001UUR MDL No:MFCD27987000
Product Description
Catalog Number:
AG001UUR
Chemical Name:
Piperazine, 1-methyl-4-[1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclopropyl]-
CAS Number:
1643923-77-6
Molecular Formula:
C20H31BN2O2
Molecular Weight:
342.2833
MDL Number:
MFCD27987000
IUPAC Name:
1-methyl-4-[1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclopropyl]piperazine
InChI:
InChI=1S/C20H31BN2O2/c1-18(2)19(3,4)25-21(24-18)17-8-6-16(7-9-17)20(10-11-20)23-14-12-22(5)13-15-23/h6-9H,10-15H2,1-5H3
InChI Key:
ZDQBKDLXCYXXMA-UHFFFAOYSA-N
SMILES:
CN1CCN(CC1)C1(CC1)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
474
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.248g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
342.29g/mol
Monoisotopic Mass:
342.248g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
24.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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