Home Nitriles 5,6-Dimethoxynicotinonitrile

5,6-Dimethoxynicotinonitrile

CAS No.:
1112851-31-6
Catalog Number:
AG00946Z
Molecular Formula:
C8H8N2O2
Molecular Weight:
164.1613
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$282
- +
1g
95%
In Stock USA
United States
$625
- +
Product Description
Catalog Number:
AG00946Z
Chemical Name:
5,6-Dimethoxynicotinonitrile
CAS Number:
1112851-31-6
Molecular Formula:
C8H8N2O2
Molecular Weight:
164.1613
MDL Number:
MFCD11857660
IUPAC Name:
5,6-dimethoxypyridine-3-carbonitrile
InChI:
InChI=1S/C8H8N2O2/c1-11-7-3-6(4-9)5-10-8(7)12-2/h3,5H,1-2H3
InChI Key:
NSGJRTBSLYQQTP-UHFFFAOYSA-N
SMILES:
COc1cc(C#N)cnc1OC
Properties
Complexity:
187  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.059g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.164g/mol
Monoisotopic Mass:
164.059g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties