Home Carboxys 3-(4-Chlorophenyl)piperazine-1-carboxylic acid tert-butyl ester

3-(4-Chlorophenyl)piperazine-1-carboxylic acid tert-butyl ester

CAS No.:
886767-49-3
Catalog Number:
AG0048C9
Molecular Formula:
C15H21ClN2O2
Molecular Weight:
296.7924
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$75
- +
1g
98%
In Stock USA
United States
$169
- +
5g
98%
In Stock USA
United States
$650
- +
Product Description
Catalog Number:
AG0048C9
Chemical Name:
3-(4-Chlorophenyl)piperazine-1-carboxylic acid tert-butyl ester
CAS Number:
886767-49-3
Molecular Formula:
C15H21ClN2O2
Molecular Weight:
296.7924
MDL Number:
MFCD03840084
IUPAC Name:
tert-butyl 3-(4-chlorophenyl)piperazine-1-carboxylate
InChI:
InChI=1S/C15H21ClN2O2/c1-15(2,3)20-14(19)18-9-8-17-13(10-18)11-4-6-12(16)7-5-11/h4-7,13,17H,8-10H2,1-3H3
InChI Key:
WWWIVVADARKSAS-UHFFFAOYSA-N
SMILES:
O=C(N1CCNC(C1)c1ccc(cc1)Cl)OC(C)(C)C
Properties
Complexity:
335  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.129g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
296.795g/mol
Monoisotopic Mass:
296.129g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties