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Home > Boronic Acids > 1218791-17-3
1218791-17-3 | 1H-Pyrrole, 1-methyl-2,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS No: 1218791-17-3 Catalog No: AG0016AT MDL No:MFCD13195753
Product Description
Catalog Number:
AG0016AT
Chemical Name:
1H-Pyrrole, 1-methyl-2,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS Number:
1218791-17-3
Molecular Formula:
C17H29B2NO4
Molecular Weight:
333.0385
MDL Number:
MFCD13195753
IUPAC Name:
1-methyl-2,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrole
InChI:
InChI=1S/C17H29B2NO4/c1-14(2)15(3,4)22-18(21-14)12-10-11-13(20(12)9)19-23-16(5,6)17(7,8)24-19/h10-11H,1-9H3
InChI Key:
OCVGYKJQPDKDJK-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccc(n1C)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
433
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333.228g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
333.042g/mol
Monoisotopic Mass:
333.228g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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