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Home > Boronic Acids > 1218790-45-4
1218790-45-4 | Pyrrolidine, 1-[[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-thienyl]methyl]-
CAS No: 1218790-45-4 Catalog No: AG00169W MDL No:MFCD11113037
Product Description
Catalog Number:
AG00169W
Chemical Name:
Pyrrolidine, 1-[[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-thienyl]methyl]-
CAS Number:
1218790-45-4
Molecular Formula:
C15H24BNO2S
Molecular Weight:
293.2326
MDL Number:
MFCD11113037
IUPAC Name:
1-[[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophen-2-yl]methyl]pyrrolidine
InChI:
InChI=1S/C15H24BNO2S/c1-14(2)15(3,4)19-16(18-14)13-8-7-12(20-13)11-17-9-5-6-10-17/h7-8H,5-6,9-11H2,1-4H3
InChI Key:
VWOUUXTUYSWOCT-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccc(s1)CN1CCCC1
Properties
Complexity:
342
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.162g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.232g/mol
Monoisotopic Mass:
293.162g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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