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Home > Bromides > 1214332-49-6
1214332-49-6 | 2-Pyridinecarboxylic acid, 3-bromo-6-methoxy-, methyl ester
CAS No: 1214332-49-6 Catalog No: AG0014T8 MDL No:MFCD14698131
Product Description
Catalog Number:
AG0014T8
Chemical Name:
2-Pyridinecarboxylic acid, 3-bromo-6-methoxy-, methyl ester
CAS Number:
1214332-49-6
Molecular Formula:
C8H8BrNO3
Molecular Weight:
246.0580
MDL Number:
MFCD14698131
IUPAC Name:
methyl 3-bromo-6-methoxypyridine-2-carboxylate
InChI:
InChI=1S/C8H8BrNO3/c1-12-6-4-3-5(9)7(10-6)8(11)13-2/h3-4H,1-2H3
InChI Key:
IYVPMSVCGWJEGJ-UHFFFAOYSA-N
SMILES:
COc1ccc(c(n1)C(=O)OC)Br
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.969g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.06g/mol
Monoisotopic Mass:
244.969g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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