Home Nitriles 3-Ethoxy-4-methoxybenzonitrile

3-Ethoxy-4-methoxybenzonitrile

CAS No.:
60758-86-3
Catalog Number:
AG00E93G
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
>98.0%(GC)
1 week
United States
$210
- +
25g
>98.0%(GC)
1 week
United States
$630
- +
Product Description
Catalog Number:
AG00E93G
Chemical Name:
3-Ethoxy-4-methoxybenzonitrile
CAS Number:
60758-86-3
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
MDL Number:
MFCD02256160
IUPAC Name:
3-ethoxy-4-methoxybenzonitrile
InChI:
InChI=1S/C10H11NO2/c1-3-13-10-6-8(7-11)4-5-9(10)12-2/h4-6H,3H2,1-2H3
InChI Key:
XTIINWPNAMHVDG-UHFFFAOYSA-N
SMILES:
CCOc1cc(C#N)ccc1OC
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.079g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.203g/mol
Monoisotopic Mass:
177.079g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties