200,000+ products from a single source!
sales@angenechem.com
Home > Bromides > 1260871-28-0
1260871-28-0 | 2-Pyrazinecarboxylic acid, 5-bromo-3-(1H-pyrrol-1-yl)-, methyl ester
CAS No: 1260871-28-0 Catalog No: AG000RHO MDL No:
Product Description
Catalog Number:
AG000RHO
Chemical Name:
2-Pyrazinecarboxylic acid, 5-bromo-3-(1H-pyrrol-1-yl)-, methyl ester
CAS Number:
1260871-28-0
Molecular Formula:
C10H8BrN3O2
Molecular Weight:
282.0934
IUPAC Name:
methyl 5-bromo-3-pyrrol-1-ylpyrazine-2-carboxylate
InChI:
InChI=1S/C10H8BrN3O2/c1-16-10(15)8-9(13-7(11)6-12-8)14-4-2-3-5-14/h2-6H,1H3
InChI Key:
XXGXWKYBXJETSX-UHFFFAOYSA-N
SMILES:
COC(=O)c1ncc(nc1n1cccc1)Br
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.98g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.097g/mol
Monoisotopic Mass:
280.98g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.