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Home > Boronic Acids > 149716-79-0
149716-79-0 | 1-Pyrrolidinecarboxylic acid, 2-borono-, 1-(1,1-dimethylethyl) ester, (2S)-
CAS No: 149716-79-0 Catalog No: AG001LY8 MDL No:MFCD17015042
Product Description
Catalog Number:
AG001LY8
Chemical Name:
1-Pyrrolidinecarboxylic acid, 2-borono-, 1-(1,1-dimethylethyl) ester, (2S)-
CAS Number:
149716-79-0
Molecular Formula:
C9H18BNO4
Molecular Weight:
215.0545
MDL Number:
MFCD17015042
IUPAC Name:
[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]boronic acid
InChI:
InChI=1S/C9H18BNO4/c1-9(2,3)15-8(12)11-6-4-5-7(11)10(13)14/h7,13-14H,4-6H2,1-3H3/t7-/m1/s1
InChI Key:
UIIUYLRUCQCTST-SSDOTTSWSA-N
SMILES:
OB([C@H]1CCCN1C(=O)OC(C)(C)C)O
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
215.133g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
215.056g/mol
Monoisotopic Mass:
215.133g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
70A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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