Home Halogens 1-N-Boc-4-(4-bromo-2-chlorophenoxy)piperidine

1-N-Boc-4-(4-bromo-2-chlorophenoxy)piperidine

CAS No.:
1159825-39-4
Catalog Number:
AG00HD69
Molecular Formula:
C16H21BrClNO3
Molecular Weight:
390.6998
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$100
- +
5g
97%
In Stock USA
United States
$300
- +
Product Description
Catalog Number:
AG00HD69
Chemical Name:
1-N-Boc-4-(4-bromo-2-chlorophenoxy)piperidine
CAS Number:
1159825-39-4
Molecular Formula:
C16H21BrClNO3
Molecular Weight:
390.6998
MDL Number:
MFCD12068409
IUPAC Name:
tert-butyl 4-(4-bromo-2-chlorophenoxy)piperidine-1-carboxylate
InChI:
InChI=1S/C16H21BrClNO3/c1-16(2,3)22-15(20)19-8-6-12(7-9-19)21-14-5-4-11(17)10-13(14)18/h4-5,10,12H,6-9H2,1-3H3
InChI Key:
HVQNGOMNKHVTBV-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)Cl)OC1CCN(CC1)C(=O)OC(C)(C)C
Properties
Complexity:
380  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
389.039g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
390.702g/mol
Monoisotopic Mass:
389.039g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  
Properties