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Home > Boronic Acids > 937048-39-0
937048-39-0 | (3-[4-(tert-Butoxycarbonyl)piperazin-1-yl]phenyl)boronic acid
CAS No: 937048-39-0 Catalog No: AG00GTEM MDL No:MFCD10696664
Product Description
Catalog Number:
AG00GTEM
Chemical Name:
(3-[4-(tert-Butoxycarbonyl)piperazin-1-yl]phenyl)boronic acid
CAS Number:
937048-39-0
Molecular Formula:
C15H23BN2O4
Molecular Weight:
306.1651
MDL Number:
MFCD10696664
IUPAC Name:
[3-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]phenyl]boronic acid
InChI:
InChI=1S/C15H23BN2O4/c1-15(2,3)22-14(19)18-9-7-17(8-10-18)13-6-4-5-12(11-13)16(20)21/h4-6,11,20-21H,7-10H2,1-3H3
InChI Key:
JBOOIEDHOGPRIZ-UHFFFAOYSA-N
SMILES:
O=C(N1CCN(CC1)c1cccc(c1)B(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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