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

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

CAS No.:
886767-25-5
Catalog Number:
AG00IFC1
Molecular Formula:
C15H21FN2O2
Molecular Weight:
280.3378
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$375
- +
1g
95%
In Stock USA
United States
$950
- +
Product Description
Catalog Number:
AG00IFC1
Chemical Name:
3-(4-Fluoro-phenyl)-piperazine-1-carboxylic acid tert-butyl ester
CAS Number:
886767-25-5
Molecular Formula:
C15H21FN2O2
Molecular Weight:
280.3378
MDL Number:
MFCD08685992
IUPAC Name:
tert-butyl 3-(4-fluorophenyl)piperazine-1-carboxylate
InChI:
InChI=1S/C15H21FN2O2/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:
CFBUTNFXRFULBP-UHFFFAOYSA-N
SMILES:
O=C(N1CCNC(C1)c1ccc(cc1)F)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:
280.159g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
280.343g/mol
Monoisotopic Mass:
280.159g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties