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Home > Bromides > 1215359-29-7
1215359-29-7 | 5-(5-Bromopyridin-3-yl)cyclohexane-1,3-dione
CAS No: 1215359-29-7 Catalog No: AG01FAKP MDL No:
Product Description
Catalog Number:
AG01FAKP
Chemical Name:
5-(5-Bromopyridin-3-yl)cyclohexane-1,3-dione
CAS Number:
1215359-29-7
Molecular Formula:
C11H10BrNO2
Molecular Weight:
268.1066
IUPAC Name:
5-(5-bromopyridin-3-yl)cyclohexane-1,3-dione
InChI:
InChI=1S/C11H10BrNO2/c12-9-1-8(5-13-6-9)7-2-10(14)4-11(15)3-7/h1,5-7H,2-4H2
InChI Key:
RKEKNDQRLLEKBY-UHFFFAOYSA-N
SMILES:
O=C1CC(=O)CC(C1)c1cncc(c1)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
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