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Home Other Building Blocks 4-(1-Piperazinyl)benzoic acid t-butyl ester

4-(1-Piperazinyl)benzoic acid t-butyl ester

CAS No.:
187669-28-9
Catalog Number:
AG003UK9
Molecular Formula:
C15H22N2O2
Molecular Weight:
262.3474
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$200
- +
5g
>95%
In Stock USA
United States
$346
- +
Product Description
Catalog Number:
AG003UK9
Chemical Name:
4-(1-Piperazinyl)benzoic acid t-butyl ester
CAS Number:
187669-28-9
Molecular Formula:
C15H22N2O2
Molecular Weight:
262.3474
MDL Number:
MFCD09608130
IUPAC Name:
tert-butyl 4-piperazin-1-ylbenzoate
InChI:
InChI=1S/C15H22N2O2/c1-15(2,3)19-14(18)12-4-6-13(7-5-12)17-10-8-16-9-11-17/h4-7,16H,8-11H2,1-3H3
InChI Key:
KROXQOZMVCDQGV-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)N1CCNCC1)OC(C)(C)C
Properties
Complexity:
298  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.168g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
262.353g/mol
Monoisotopic Mass:
262.168g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties