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Home > Bromides > 1256561-52-0
1256561-52-0 | 3-Pyridinecarboxylic acid, 2-bromo-4-chloro-, ethyl ester
CAS No: 1256561-52-0 Catalog No: AG000O9L MDL No:
Product Description
Catalog Number:
AG000O9L
Chemical Name:
3-Pyridinecarboxylic acid, 2-bromo-4-chloro-, ethyl ester
CAS Number:
1256561-52-0
Molecular Formula:
C8H7BrClNO2
Molecular Weight:
264.5037
IUPAC Name:
ethyl 2-bromo-4-chloropyridine-3-carboxylate
InChI:
InChI=1S/C8H7BrClNO2/c1-2-13-8(12)6-5(10)3-4-11-7(6)9/h3-4H,2H2,1H3
InChI Key:
WQSVIFKDORWTIL-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c(Cl)ccnc1Br
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.935g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.503g/mol
Monoisotopic Mass:
262.935g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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