200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 1150114-76-3
1150114-76-3 | 1-Piperazinecarboxylic acid, 4-(4-boronobenzoyl)-, 1-(1,1-dimethylethyl) ester
CAS No: 1150114-76-3 Catalog No: AG000FN3 MDL No:MFCD12025996
Product Description
Catalog Number:
AG000FN3
Chemical Name:
1-Piperazinecarboxylic acid, 4-(4-boronobenzoyl)-, 1-(1,1-dimethylethyl) ester
CAS Number:
1150114-76-3
Molecular Formula:
C16H23BN2O5
Molecular Weight:
334.1752
MDL Number:
MFCD12025996
IUPAC Name:
[4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazine-1-carbonyl]phenyl]boronic acid
InChI:
InChI=1S/C16H23BN2O5/c1-16(2,3)24-15(21)19-10-8-18(9-11-19)14(20)12-4-6-13(7-5-12)17(22)23/h4-7,22-23H,8-11H2,1-3H3
InChI Key:
LJJBJECKHAIPNO-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)C(=O)N1CCN(CC1)C(=O)OC(C)(C)C)O
Properties
Complexity:
450
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
334.17g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
334.179g/mol
Monoisotopic Mass:
334.17g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
90.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.