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Home > Bromides > 1215549-29-3
1215549-29-3 | 5-(6-Bromopyridin-2-yl)cyclohexane-1,3-dione
CAS No: 1215549-29-3 Catalog No: AG01FAKQ MDL No:
Product Description
Catalog Number:
AG01FAKQ
Chemical Name:
5-(6-Bromopyridin-2-yl)cyclohexane-1,3-dione
CAS Number:
1215549-29-3
Molecular Formula:
C11H10BrNO2
Molecular Weight:
268.1066
IUPAC Name:
5-(6-bromopyridin-2-yl)cyclohexane-1,3-dione
InChI:
InChI=1S/C11H10BrNO2/c12-11-3-1-2-10(13-11)7-4-8(14)6-9(15)5-7/h1-3,7H,4-6H2
InChI Key:
ZPNYDZQUSQTMAT-UHFFFAOYSA-N
SMILES:
O=C1CC(CC(=O)C1)c1cccc(n1)Br
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.989g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.11g/mol
Monoisotopic Mass:
266.989g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
47A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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