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Home > Boronic Acids > 915770-01-3

915770-01-3

915770-01-3 | 2-[4-(tert-Butoxycarbonyl)piperazine-1-yl]phenylboronic acid

CAS No: 915770-01-3 Catalog No: AG006GYZ MDL No:MFCD09753310

Product Description

Catalog Number:
AG006GYZ
Chemical Name:
2-[4-(tert-Butoxycarbonyl)piperazine-1-yl]phenylboronic acid
CAS Number:
915770-01-3
Molecular Formula:
C15H23BN2O4
Molecular Weight:
306.1651
MDL Number:
MFCD09753310
IUPAC Name:
[2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]phenyl]boronic acid
InChI:
InChI=1S/C15H23BN2O4/c1-15(2,3)22-14(19)18-10-8-17(9-11-18)13-7-5-4-6-12(13)16(20)21/h4-7,20-21H,8-11H2,1-3H3
InChI Key:
CVTSGDSTXRXWPI-UHFFFAOYSA-N
SMILES:
O=C(N1CCN(CC1)c1ccccc1B(O)O)OC(C)(C)C

Properties

Complexity:
378  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.175g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
306.169g/mol
Monoisotopic Mass:
306.175g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
73.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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