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Home > Bromides > 1235036-15-3
1235036-15-3 | 2-Pyridinecarboxylic acid, 3-bromo-6-chloro-, 1,1-dimethylethyl ester
CAS No: 1235036-15-3 Catalog No: AG000KP4 MDL No:MFCD19443279
Product Description
Catalog Number:
AG000KP4
Chemical Name:
2-Pyridinecarboxylic acid, 3-bromo-6-chloro-, 1,1-dimethylethyl ester
CAS Number:
1235036-15-3
Molecular Formula:
C10H11BrClNO2
Molecular Weight:
292.5568
MDL Number:
MFCD19443279
IUPAC Name:
tert-butyl 3-bromo-6-chloropyridine-2-carboxylate
InChI:
InChI=1S/C10H11BrClNO2/c1-10(2,3)15-9(14)8-6(11)4-5-7(12)13-8/h4-5H,1-3H3
InChI Key:
JKGXLKXQUDHRLL-UHFFFAOYSA-N
SMILES:
O=C(c1nc(Cl)ccc1Br)OC(C)(C)C
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.966g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
292.557g/mol
Monoisotopic Mass:
290.966g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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