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1187165-79-2 | 5-(3-Bromobenzoyl)-2-chloropyridine
CAS No: 1187165-79-2 Catalog No: AG01FDR8 MDL No:
Product Description
Catalog Number:
AG01FDR8
Chemical Name:
5-(3-Bromobenzoyl)-2-chloropyridine
CAS Number:
1187165-79-2
Molecular Formula:
C12H7BrClNO
Molecular Weight:
296.5471
IUPAC Name:
(3-bromophenyl)-(6-chloropyridin-3-yl)methanone
InChI:
InChI=1S/C12H7BrClNO/c13-10-3-1-2-8(6-10)12(16)9-4-5-11(14)15-7-9/h1-7H
InChI Key:
KEGVBAVHXNRWAQ-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)C(=O)c1ccc(nc1)Cl
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.94g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.548g/mol
Monoisotopic Mass:
294.94g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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