Home Nitriles 2-Chloro-4-methoxynicotinonitrile

2-Chloro-4-methoxynicotinonitrile

CAS No.:
98645-43-3
Catalog Number:
AG006R3W
Molecular Formula:
C7H5ClN2O
Molecular Weight:
168.5804
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$48
- +
5g
98%
In Stock USA
United States
$200
- +
25g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG006R3W
Chemical Name:
2-Chloro-4-methoxynicotinonitrile
CAS Number:
98645-43-3
Molecular Formula:
C7H5ClN2O
Molecular Weight:
168.5804
MDL Number:
MFCD00975444
IUPAC Name:
2-chloro-4-methoxypyridine-3-carbonitrile
InChI:
InChI=1S/C7H5ClN2O/c1-11-6-2-3-10-7(8)5(6)4-9/h2-3H,1H3
InChI Key:
MOKUXMQJIYHZCA-UHFFFAOYSA-N
SMILES:
COc1ccnc(c1C#N)Cl
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.009g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.58g/mol
Monoisotopic Mass:
168.009g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties