Home Nitriles 4-[(Diethylamino)methyl]benzonitrile

4-[(Diethylamino)methyl]benzonitrile

CAS No.:
69293-74-9
Catalog Number:
AG00IBX7
Molecular Formula:
C12H16N2
Molecular Weight:
188.2688
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$100
- +
5g
98%
In Stock USA
United States
$375
- +
Product Description
Catalog Number:
AG00IBX7
Chemical Name:
4-[(Diethylamino)methyl]benzonitrile
CAS Number:
69293-74-9
Molecular Formula:
C12H16N2
Molecular Weight:
188.2688
MDL Number:
MFCD09948026
IUPAC Name:
4-(diethylaminomethyl)benzonitrile
InChI:
InChI=1S/C12H16N2/c1-3-14(4-2)10-12-7-5-11(9-13)6-8-12/h5-8H,3-4,10H2,1-2H3
InChI Key:
XWLYXADFVFHUKA-UHFFFAOYSA-N
SMILES:
CCN(Cc1ccc(cc1)C#N)CC
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.131g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.274g/mol
Monoisotopic Mass:
188.131g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties