200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 1150114-43-4
1150114-43-4 | 1H-Pyrrole-1,2-dicarboxylic acid, 5-borono-, 1-(1,1-dimethylethyl) 2-methyl ester
CAS No: 1150114-43-4 Catalog No: AG000FLK MDL No:MFCD11855841
Product Description
Catalog Number:
AG000FLK
Chemical Name:
1H-Pyrrole-1,2-dicarboxylic acid, 5-borono-, 1-(1,1-dimethylethyl) 2-methyl ester
CAS Number:
1150114-43-4
Molecular Formula:
C11H16BNO6
Molecular Weight:
269.0588
MDL Number:
MFCD11855841
IUPAC Name:
[5-methoxycarbonyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrol-2-yl]boronic acid
InChI:
InChI=1S/C11H16BNO6/c1-11(2,3)19-10(15)13-7(9(14)18-4)5-6-8(13)12(16)17/h5-6,16-17H,1-4H3
InChI Key:
MUBAJJNRNZMQAJ-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(n1C(=O)OC(C)(C)C)B(O)O
Properties
Complexity:
354
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.107g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
269.06g/mol
Monoisotopic Mass:
269.107g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
98A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.