Home Nitriles 2-Chloro-4-methoxypyrimidine-5-carbonitrile

2-Chloro-4-methoxypyrimidine-5-carbonitrile

CAS No.:
1106295-93-5
Catalog Number:
AG0083IN
Molecular Formula:
C6H4ClN3O
Molecular Weight:
169.5685
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$107
- +
1g
98%
In Stock USA
United States
$263
- +
5g
98%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG0083IN
Chemical Name:
2-Chloro-4-methoxypyrimidine-5-carbonitrile
CAS Number:
1106295-93-5
Molecular Formula:
C6H4ClN3O
Molecular Weight:
169.5685
MDL Number:
MFCD16250650
IUPAC Name:
2-chloro-4-methoxypyrimidine-5-carbonitrile
InChI:
InChI=1S/C6H4ClN3O/c1-11-5-4(2-8)3-9-6(7)10-5/h3H,1H3
InChI Key:
YIGFAXAWUVBGGI-UHFFFAOYSA-N
SMILES:
COc1nc(Cl)ncc1C#N
Properties
Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.004g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.568g/mol
Monoisotopic Mass:
169.004g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
58.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties