Home Nitriles 4-(Piperidin-4-yloxy)benzonitrile, HCl

4-(Piperidin-4-yloxy)benzonitrile, HCl

CAS No.:
333954-90-8
Catalog Number:
AG00D4O8
Molecular Formula:
C12H15ClN2O
Molecular Weight:
238.7133
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
≥ 98% (HPLC)
1 week
United States
$148
- +
250mg
≥ 98% (HPLC)
1 week
United States
$250
- +
1g
≥ 98% (HPLC)
1 week
United States
$462
- +
5g
≥ 98% (HPLC)
1 week
United States
$1471
- +
Product Description
Catalog Number:
AG00D4O8
Chemical Name:
4-(Piperidin-4-yloxy)benzonitrile, HCl
CAS Number:
333954-90-8
Molecular Formula:
C12H15ClN2O
Molecular Weight:
238.7133
MDL Number:
MFCD08544113
IUPAC Name:
4-piperidin-4-yloxybenzonitrile;hydrochloride
InChI:
InChI=1S/C12H14N2O.ClH/c13-9-10-1-3-11(4-2-10)15-12-5-7-14-8-6-12;/h1-4,12,14H,5-8H2;1H
InChI Key:
VXGQMTUMJLRDDQ-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)OC1CCNCC1.Cl
Properties
Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.087g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
238.715g/mol
Monoisotopic Mass:
238.087g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
45A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties