Home Nitriles 2-Chloro-4-(4-piperidinyloxy)benzonitrile

2-Chloro-4-(4-piperidinyloxy)benzonitrile

CAS No.:
796600-10-7
Catalog Number:
AG003GWB
Molecular Formula:
C12H13ClN2O
Molecular Weight:
236.6974
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$607
- +
5g
1 week
United States
$2739
- +
10g
1 week
United States
$4631
- +
25g
1 week
United States
$8649
- +
Product Description
Catalog Number:
AG003GWB
Chemical Name:
2-Chloro-4-(4-piperidinyloxy)benzonitrile
CAS Number:
796600-10-7
Molecular Formula:
C12H13ClN2O
Molecular Weight:
236.6974
MDL Number:
MFCD08060977
IUPAC Name:
2-chloro-4-piperidin-4-yloxybenzonitrile
InChI:
InChI=1S/C12H13ClN2O/c13-12-7-11(2-1-9(12)8-14)16-10-3-5-15-6-4-10/h1-2,7,10,15H,3-6H2
InChI Key:
AZTMLAAAPWXHMV-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1Cl)OC1CCNCC1
Properties
Complexity:
269  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.072g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
236.699g/mol
Monoisotopic Mass:
236.072g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
45A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties