Home Nitriles 3-(4-Methoxyphenyl)propanenitrile

3-(4-Methoxyphenyl)propanenitrile

CAS No.:
22442-48-4
Catalog Number:
AG00BCSW
Molecular Formula:
C10H11NO
Molecular Weight:
161.2004
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$50
- +
5g
97%
In Stock USA
United States
$75
- +
10g
97%
In Stock USA
United States
$144
- +
25g
97%
In Stock USA
United States
$325
- +
Product Description
Catalog Number:
AG00BCSW
Chemical Name:
3-(4-Methoxyphenyl)propanenitrile
CAS Number:
22442-48-4
Molecular Formula:
C10H11NO
Molecular Weight:
161.2004
MDL Number:
MFCD00016404
IUPAC Name:
3-(4-methoxyphenyl)propanenitrile
InChI:
InChI=1S/C10H11NO/c1-12-10-6-4-9(5-7-10)3-2-8-11/h4-7H,2-3H2,1H3
InChI Key:
ORAXBZFDDWPRRD-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)CCC#N
Properties
Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.084g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
161.204g/mol
Monoisotopic Mass:
161.084g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties