Home Halogens Methyl 6-bromo-1H-pyrazolo-[4,3-b]pyridine-3-carboxylate

Methyl 6-bromo-1H-pyrazolo-[4,3-b]pyridine-3-carboxylate

CAS No.:
1363380-66-8
Catalog Number:
AG00HUIY
Molecular Formula:
C8H6BrN3O2
Molecular Weight:
256.0561
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00HUIY
Chemical Name:
Methyl 6-bromo-1H-pyrazolo-[4,3-b]pyridine-3-carboxylate
CAS Number:
1363380-66-8
Molecular Formula:
C8H6BrN3O2
Molecular Weight:
256.0561
IUPAC Name:
methyl 6-bromo-1H-pyrazolo[4,3-b]pyridine-3-carboxylate
InChI:
InChI=1S/C8H6BrN3O2/c1-14-8(13)7-6-5(11-12-7)2-4(9)3-10-6/h2-3H,1H3,(H,11,12)
InChI Key:
LRXKDBPNQMRGIN-UHFFFAOYSA-N
SMILES:
COC(=O)c1n[nH]c2c1ncc(c2)Br
Properties
Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.964g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
256.059g/mol
Monoisotopic Mass:
254.964g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties