Home Halogens ethyl 6-bromo-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate

ethyl 6-bromo-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate

CAS No.:
2059932-43-1
Catalog Number:
AG01BVAE
Molecular Formula:
C9H8BrN3O2
Molecular Weight:
270.0827
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Product Description
Catalog Number:
AG01BVAE
Chemical Name:
ethyl 6-bromo-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate
CAS Number:
2059932-43-1
Molecular Formula:
C9H8BrN3O2
Molecular Weight:
270.0827
MDL Number:
MFCD30497578
IUPAC Name:
ethyl 6-bromo-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate
InChI:
InChI=1S/C9H8BrN3O2/c1-2-15-9(14)7-3-6(10)4-13-8(7)11-5-12-13/h3-5H,2H2,1H3
InChI Key:
VJNVFGHMUTYTMS-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(Br)cn2c1ncn2
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.98g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.086g/mol
Monoisotopic Mass:
268.98g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties