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Home > Bromides > 1256788-33-6
1256788-33-6 | 2-Pyridinecarboxylic acid, 5-bromo-3-chloro-6-methoxy-, methyl ester
CAS No: 1256788-33-6 Catalog No: AG000OCG MDL No:
Product Description
Catalog Number:
AG000OCG
Chemical Name:
2-Pyridinecarboxylic acid, 5-bromo-3-chloro-6-methoxy-, methyl ester
CAS Number:
1256788-33-6
Molecular Formula:
C8H7BrClNO3
Molecular Weight:
280.5031
IUPAC Name:
methyl 5-bromo-3-chloro-6-methoxypyridine-2-carboxylate
InChI:
InChI=1S/C8H7BrClNO3/c1-13-7-4(9)3-5(10)6(11-7)8(12)14-2/h3H,1-2H3
InChI Key:
MOTMOSIDQFBDHJ-UHFFFAOYSA-N
SMILES:
COC(=O)c1nc(OC)c(cc1Cl)Br
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.93g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.502g/mol
Monoisotopic Mass:
278.93g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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