Home Nitriles 2-Bromo-6-piperidinobenzonitrile

2-Bromo-6-piperidinobenzonitrile

CAS No.:
1260649-11-3
Catalog Number:
AG000QYH
Molecular Formula:
C12H13BrN2
Molecular Weight:
265.1490
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
25g
98%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG000QYH
Chemical Name:
2-Bromo-6-piperidinobenzonitrile
CAS Number:
1260649-11-3
Molecular Formula:
C12H13BrN2
Molecular Weight:
265.1490
MDL Number:
MFCD11037745
IUPAC Name:
2-bromo-6-piperidin-1-ylbenzonitrile
InChI:
InChI=1S/C12H13BrN2/c13-11-5-4-6-12(10(11)9-14)15-7-2-1-3-8-15/h4-6H,1-3,7-8H2
InChI Key:
PECAOGIZKHOSKX-UHFFFAOYSA-N
SMILES:
N#Cc1c(Br)cccc1N1CCCCC1
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.026g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.154g/mol
Monoisotopic Mass:
264.026g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties