Home Halogens Methyl 5-bromo-6-cyanopicolinate

Methyl 5-bromo-6-cyanopicolinate

CAS No.:
959741-33-4
Catalog Number:
AG006TR3
Molecular Formula:
C8H5BrN2O2
Molecular Weight:
241.0415
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
98%
In Stock USA
United States
$219
- +
250mg
98%
In Stock USA
United States
$350
- +
1g
98%
In Stock USA
United States
$894
- +
Product Description
Catalog Number:
AG006TR3
Chemical Name:
Methyl 5-bromo-6-cyanopicolinate
CAS Number:
959741-33-4
Molecular Formula:
C8H5BrN2O2
Molecular Weight:
241.0415
MDL Number:
MFCD08062838
IUPAC Name:
methyl 5-bromo-6-cyanopyridine-2-carboxylate
InChI:
InChI=1S/C8H5BrN2O2/c1-13-8(12)6-3-2-5(9)7(4-10)11-6/h2-3H,1H3
InChI Key:
GVHAAOWHVZMDRP-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(n1)C#N)Br
Properties
Complexity:
248  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.953g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.044g/mol
Monoisotopic Mass:
239.953g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties