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Home Halogens 1-Boc-4-(4-bromo-2-formylphenyl)piperazine

1-Boc-4-(4-bromo-2-formylphenyl)piperazine

CAS No.:
628326-05-6
Catalog Number:
AG00EDTA
Molecular Formula:
C16H21BrN2O3
Molecular Weight:
369.2535
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$114
- +
1g
98%
In Stock USA
United States
$288
- +
5g
98%
In Stock USA
United States
$1150
- +
Product Description
Catalog Number:
AG00EDTA
Chemical Name:
1-Boc-4-(4-bromo-2-formylphenyl)piperazine
CAS Number:
628326-05-6
Molecular Formula:
C16H21BrN2O3
Molecular Weight:
369.2535
MDL Number:
MFCD09817615
IUPAC Name:
tert-butyl 4-(4-bromo-2-formylphenyl)piperazine-1-carboxylate
InChI:
InChI=1S/C16H21BrN2O3/c1-16(2,3)22-15(21)19-8-6-18(7-9-19)14-5-4-13(17)10-12(14)11-20/h4-5,10-11H,6-9H2,1-3H3
InChI Key:
ZFUYWWRCIVQVAZ-UHFFFAOYSA-N
SMILES:
O=Cc1cc(Br)ccc1N1CCN(CC1)C(=O)OC(C)(C)C
Properties
Complexity:
403  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
368.074g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
369.259g/mol
Monoisotopic Mass:
368.074g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties