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Home > Bromides > 1805151-37-4
1805151-37-4 | 3-Pyridinecarboxylic acid, 2-bromo-6-methoxy-, ethyl ester
CAS No: 1805151-37-4 Catalog No: AG002221 MDL No:
Product Description
Catalog Number:
AG002221
Chemical Name:
3-Pyridinecarboxylic acid, 2-bromo-6-methoxy-, ethyl ester
CAS Number:
1805151-37-4
Molecular Formula:
C9H10BrNO3
Molecular Weight:
260.0846
IUPAC Name:
ethyl 2-bromo-6-methoxypyridine-3-carboxylate
InChI:
InChI=1S/C9H10BrNO3/c1-3-14-9(12)6-4-5-7(13-2)11-8(6)10/h4-5H,3H2,1-2H3
InChI Key:
IFABVAGFCBOCSA-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc(nc1Br)OC
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.984g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.087g/mol
Monoisotopic Mass:
258.984g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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